data_1f3c_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 1f3c _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 5' ' ' LYS . . . . . 0.752 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 17.6 tptp . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.942 0.401 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.052 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -110.23 -172.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.954 0.407 . . . . 0.0 111.263 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.544 HG12 ' HE2' ' A' ' 9' ' ' LYS . 95.6 t -140.04 77.35 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.747 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.803 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -42.85 149.86 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.064 0.459 . . . . 0.0 110.839 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.544 ' HE2' HG12 ' A' ' 7' ' ' VAL . 2.4 mmtt -137.71 -13.85 1.46 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.329 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -176.32 112.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.45 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.785 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -131.71 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 0.0 111.682 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.692 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -137.87 25.86 2.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.694 179.326 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.786 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 25.7 ttp -117.08 166.44 12.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.723 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.984 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 74.4 m -51.92 135.93 29.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.715 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.7 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -41.81 -77.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.742 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.636 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.7 OUTLIER -45.95 -19.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.474 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.984 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.16 -42.22 26.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.45 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.785 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -69.27 -28.37 66.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.492 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.682 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 2.2 pt20 -75.78 -45.79 34.26 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.682 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 2.1 m-20 -67.11 -30.82 70.95 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.76 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.786 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 29.0 t -65.08 -47.61 76.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.922 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.805 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 56.4 t -57.85 -48.09 84.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.799 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 52.3 mt-10 -60.74 -38.3 84.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.353 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.63 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 57.1 m -66.41 -34.08 77.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.193 0.521 . . . . 0.0 109.668 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.746 ' HB2' HG22 ' A' ' 83' ' ' ILE . . . -70.21 -39.9 74.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.999 ' HA ' HD12 ' A' ' 29' ' ' LEU . 55.2 m -66.09 -38.88 89.35 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.958 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.578 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 7.6 mm-40 -58.19 -41.59 84.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.806 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.989 ' HB2' ' HB3' ' A' ' 41' ' ' HIS . . . -70.97 -29.14 65.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.794 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.999 HD12 ' HA ' ' A' ' 26' ' ' THR . 1.0 OUTLIER -72.05 -41.92 66.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.026 179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.21 -36.55 77.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.184 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.506 ' HD3' ' CE1' ' A' ' 41' ' ' HIS . 2.1 mttp -79.73 -25.72 41.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.738 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.573 ' CE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.43 143.34 18.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -108.61 30.3 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.901 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.902 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 8.0 mm -110.53 111.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.849 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.724 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 8.5 mp0 -28.47 -82.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.823 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.526 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -37.19 -48.62 0.86 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.551 179.519 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.902 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.6 t70 -53.09 -63.53 1.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.76 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 5.3 mt -46.32 -47.06 6.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.805 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.795 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -56.53 -50.71 71.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.001 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.801 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -57.59 -55.46 34.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.775 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.989 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 1.2 t60 -47.1 -46.92 23.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.564 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.987 HG22 HD11 ' A' ' 85' ' ' LEU . 49.6 mt -61.1 -71.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.754 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 1.1 tmtt? -42.64 -40.56 2.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.151 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.468 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 24.3 tptt -55.57 -62.28 1.79 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.171 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.628 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp0 -62.76 -49.83 73.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.786 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -55.18 -35.67 65.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.26 -179.687 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.754 ' HB2' ' HE2' ' A' ' 43' ' ' LYS . 0.8 OUTLIER -72.02 -38.06 69.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.108 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.08 9.23 43.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.106 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.628 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -128.92 5.17 5.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.164 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.779 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 63.9 m-85 -144.61 -66.75 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.035 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.779 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 5.6 p30 162.57 109.18 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.187 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.687 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 77.0 Cg_exo -47.77 149.44 5.18 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 122.432 2.088 . . . . 0.0 112.477 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.784 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 11.0 t -119.51 135.82 54.61 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.056 0.542 . . . . 0.0 110.657 -0.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.778 ' CH2' ' HE2' ' A' ' 17' ' ' MET . 47.4 m95 -96.67 124.61 40.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 111.741 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.716 ' HB3' ' CB ' ' B' ' 66' ' ' VAL . 0.0 OUTLIER -107.94 101.98 11.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.726 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.796 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 1.9 p -116.86 152.17 35.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.265 0.555 . . . . 0.0 112.425 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.985 HD11 HG12 ' B' ' 66' ' ' VAL . 20.8 mm -130.36 110.96 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.379 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.764 HG11 ' N ' ' A' ' 39' ' ' ALA . 3.4 p -105.18 121.23 56.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.38 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.664 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -162.42 176.35 38.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.144 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.672 ' HB3' ' HA ' ' A' ' 81' ' ' VAL . 0.1 OUTLIER -138.07 40.97 2.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.651 0.262 . . . . 0.0 111.297 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.693 ' O ' ' HG2' ' B' ' 60' ' ' ARG . 2.5 t-20 168.61 25.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.885 0.374 . . . . 0.0 111.208 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.947 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 15.1 p90 -109.34 -166.95 1.15 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.609 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.833 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -150.71 102.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.047 -0.597 . . . . 0.0 111.97 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.984 ' HB2' HD21 ' A' ' 84' ' ' LEU . 88.4 p -86.11 134.57 33.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.096 0.474 . . . . 0.0 111.584 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.694 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 60.1 t80 -149.83 87.49 1.49 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.057 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.878 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 11.5 m -132.66 168.1 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.216 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.674 HG23 ' OG1' ' B' ' 53' ' ' THR . 13.2 t -92.14 83.23 5.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.561 ' C ' ' HG2' ' A' ' 69' ' ' GLU . 32.2 p-80 -55.68 -179.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.49 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.561 ' HG2' ' C ' ' A' ' 68' ' ' HIS . 0.7 OUTLIER 176.38 -166.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.918 0.39 . . . . 0.0 111.228 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.419 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 58.86 -100.23 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.836 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 13' ' ' MET . 1.3 mtmp? 179.15 28.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.991 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.786 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 3.7 m-70 -138.27 54.12 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.348 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.815 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.1 t80 -125.04 89.93 3.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.186 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.875 HG22 ' HE1' ' A' ' 76' ' ' PHE . 1.2 tt -109.55 142.44 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 111.673 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.627 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 21.6 t80 -130.96 131.55 44.49 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.063 179.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.875 ' HE1' HG22 ' A' ' 74' ' ' ILE . 1.2 p90 -154.85 179.27 9.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.152 -179.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.742 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 24.4 t80 -137.91 104.15 5.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.698 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.052 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.3 mm? -58.86 173.74 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.083 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.456 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.15 -44.59 0.17 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.039 -0.6 . . . . 0.0 112.872 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.67 ' O ' ' HG3' ' A' ' 80' ' ' GLN . 9.6 tp-100 -144.8 25.58 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.609 0.242 . . . . 0.0 111.323 -179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.684 HG13 ' H ' ' A' ' 82' ' ' ALA . 13.9 t -146.79 178.04 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.841 0.353 . . . . 0.0 111.111 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.775 ' O ' HD11 ' A' ' 83' ' ' ILE . . . -141.11 154.07 45.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.842 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.775 HD11 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -139.26 137.26 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.154 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.984 HD21 ' HB2' ' A' ' 64' ' ' SER . 3.0 tp -121.89 81.81 1.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.573 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.987 HD11 HG22 ' A' ' 42' ' ' ILE . 0.4 OUTLIER -85.87 126.66 34.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.329 -179.616 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.815 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -168.7 125.0 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.497 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.784 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -98.59 -171.27 2.09 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.631 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.547 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-O 121.238 0.542 . . . . 0.0 110.641 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.633 ' HD2' ' HA ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.744 0.307 . . . . 0.0 111.129 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.478 ' C ' HD11 ' B' ' 78' ' ' LEU . 5.9 tppt? -93.51 47.21 1.23 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.091 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.022 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.32 -175.5 3.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.301 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.554 HG13 ' HE3' ' B' ' 9' ' ' LYS . 69.3 t -141.2 74.03 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.774 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.758 ' HA ' ' HB3' ' B' ' 76' ' ' PHE . 1.1 mp -34.1 157.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.074 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.738 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 6.1 mmpt? -146.4 -15.08 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.936 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.514 HD21 ' HA ' ' B' ' 10' ' ' ASN . 0.1 OUTLIER 179.81 102.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.486 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.769 ' HB3' ' NE2' ' B' ' 18' ' ' GLN . . . -130.52 104.54 7.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.899 0.381 . . . . 0.0 111.935 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.604 ' N ' ' O ' ' B' ' 73' ' ' PHE . 4.4 t70 -89.21 30.6 0.95 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.154 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.842 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 28.4 ttp -120.96 156.06 32.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.909 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.741 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.8 OUTLIER -46.98 135.78 9.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.59 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.729 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 10.6 mm-40 -41.36 -69.7 0.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.226 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.576 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 18.0 mm-40 -44.99 -37.97 4.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.891 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.799 ' HE1' ' CE2' ' B' ' 50' ' ' TYR . 0.0 OUTLIER -65.64 -33.23 75.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.61 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.869 ' HB3' HD11 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.37 -29.48 63.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.103 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.633 ' HA ' ' HD2' ' B' ' 4' ' ' ARG . 6.7 pt20 -75.9 -41.74 51.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 0.0 110.382 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.478 ' O ' ' SG ' ' B' ' 24' ' ' CYS . 0.5 OUTLIER -73.41 -28.83 62.21 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.887 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 1.8 t -67.6 -44.27 78.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.184 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.882 HG11 ' HB3' ' B' ' 6' ' ' ALA . 47.2 t -63.26 -48.51 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.766 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.663 ' HA ' ' HG1' ' B' ' 26' ' ' THR . 85.8 mt-10 -55.06 -41.5 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.562 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.478 ' SG ' ' O ' ' B' ' 20' ' ' ASP . 75.5 m -64.39 -37.76 88.64 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.368 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.88 ' HB1' HD11 ' B' ' 83' ' ' ILE . . . -67.9 -28.22 67.32 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.663 ' HG1' ' HA ' ' B' ' 23' ' ' GLU . 3.0 m -71.67 -43.22 66.4 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.77 178.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 1.2 mt-30 -53.13 -46.62 68.86 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.619 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.651 ' O ' ' HD1' ' B' ' 32' ' ' TYR . . . -77.22 -20.26 55.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.291 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.72 HD13 ' C ' ' B' ' 25' ' ' ALA . 6.3 mt -77.19 -32.96 56.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.11 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -89.42 -27.45 20.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.371 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.729 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 41.9 mmtm -83.47 -29.32 28.11 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.917 0.389 . . . . 0.0 110.705 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.729 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -152.68 141.09 20.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.566 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.71 29.39 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.955 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 1.007 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 7.5 mm -103.61 101.28 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.868 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.833 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.9 mp0 -29.83 -68.85 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.637 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -49.48 -56.2 10.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.818 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 1.007 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -49.27 -63.67 1.04 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.679 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.755 ' O ' HG13 ' B' ' 42' ' ' ILE . 38.8 mt -42.38 -46.31 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.935 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.685 ' HB3' ' CB ' ' A' ' 65' ' ' TYR . . . -63.65 -40.64 97.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.925 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.694 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -57.67 -67.15 0.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.967 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.605 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -46.66 -57.31 4.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.728 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.755 HG13 ' O ' ' B' ' 38' ' ' ILE . 78.1 mt -43.59 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.653 ' HB3' ' HE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -36.99 -48.09 0.75 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.325 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.451 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -59.38 -45.3 91.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.549 -179.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.666 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.7 OUTLIER -69.68 -46.9 65.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.359 -179.519 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.814 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -60.85 -33.0 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.979 -179.823 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.771 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.73 -50.2 26.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.721 179.789 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.932 ' HA ' ' HE3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -72.28 -22.36 61.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.666 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -90.45 -26.57 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.799 ' CE2' ' HE1' ' B' ' 17' ' ' MET . 15.2 m-85 -120.02 -65.35 1.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.192 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.69 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 21.7 t-20 160.27 110.19 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.96 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.771 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 81.2 Cg_exo -43.84 149.79 0.68 Allowed 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 122.49 2.127 . . . . 0.0 112.717 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.674 ' OG1' HG23 ' A' ' 67' ' ' THR . 0.2 OUTLIER -125.75 137.92 53.83 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 122.955 0.502 . . . . 0.0 110.549 -0.104 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.778 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 34.2 m95 -95.28 121.5 37.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.828 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.878 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -91.09 97.91 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.437 178.672 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.867 ' HB3' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -113.72 143.44 44.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 112.448 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.978 HG23 HG22 ' A' ' 57' ' ' ILE . 21.2 mm -130.11 97.21 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.06 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.768 HG23 HD13 ' B' ' 83' ' ' ILE . 3.3 p -98.48 129.69 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.971 0.415 . . . . 0.0 111.385 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.754 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -144.96 -144.03 4.09 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.693 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.63 10.71 0.06 Allowed 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.756 0.312 . . . . 0.0 111.111 -179.659 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 2.2 t-20 175.98 30.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.933 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.947 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 9.5 p90 -102.13 -166.64 1.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.985 0.422 . . . . 0.0 110.976 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.724 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -147.82 86.76 0.16 Allowed Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.919 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.902 ' HB3' ' HE2' ' B' ' 62' ' ' PHE . 8.3 p -73.28 141.64 47.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.398 . . . . 0.0 111.533 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.801 ' CE2' ' HA ' ' A' ' 40' ' ' ALA . 12.1 t80 -147.08 62.34 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.359 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.985 HG12 HD11 ' A' ' 57' ' ' ILE . 21.5 m -102.38 161.31 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.535 ' O ' ' HG2' ' B' ' 69' ' ' GLU . 18.4 m -99.13 94.5 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.846 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.717 ' HA ' ' HD2' ' B' ' 86' ' ' PHE . 0.0 OUTLIER -31.22 -44.48 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.163 -179.853 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.568 ' HG2' ' O ' ' B' ' 68' ' ' HIS . 19.3 pt-20 43.64 36.83 1.33 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.997 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.651 HG23 ' H ' ' B' ' 71' ' ' LYS . 3.0 m -170.16 -136.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.969 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.654 ' O ' ' HA ' ' B' ' 13' ' ' MET . 10.2 mtmm -146.43 12.47 1.19 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.71 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.842 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 8.4 m-70 -119.41 47.59 1.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.678 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 6.8 t80 -116.47 116.78 28.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.53 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.869 HD11 ' HB3' ' B' ' 18' ' ' GLN . 0.8 OUTLIER -135.85 125.76 41.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.999 0.428 . . . . 0.0 111.729 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.738 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 16.6 t80 -112.07 136.64 51.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.803 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.806 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 2.3 p90 -162.56 164.1 26.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 111.246 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.518 ' O ' ' N ' ' B' ' 7' ' ' VAL . 65.4 t80 -122.52 109.62 14.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.015 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.022 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -70.27 170.37 11.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.629 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.13 -47.03 0.02 OUTLIER Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.191 -0.528 . . . . 0.0 112.932 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.574 ' O ' HG21 ' B' ' 81' ' ' VAL . 2.8 mt-30 -149.56 37.18 0.74 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.905 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.883 HG13 ' H ' ' B' ' 82' ' ' ALA . 85.6 t -154.02 170.84 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.162 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.883 ' H ' HG13 ' B' ' 81' ' ' VAL . . . -137.43 141.72 41.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.88 HD11 ' HB1' ' B' ' 25' ' ' ALA . 0.2 OUTLIER -128.24 128.6 68.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.07 0.462 . . . . 0.0 111.678 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.96 HD22 ' HB ' ' B' ' 57' ' ' ILE . 1.2 tp -116.31 85.3 2.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.031 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.867 HD12 ' HB3' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -93.03 128.94 39.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.573 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.793 ' CD1' HG21 ' B' ' 66' ' ' VAL . 1.2 p90 -167.62 123.7 1.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.849 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.778 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 32.7 mtpt -91.59 159.88 15.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.753 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.631 ' H ' ' CE1' ' B' ' 55' ' ' HIS . 32.2 m -105.17 18.31 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.302 0.572 . . . . 0.0 110.799 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.428 -1.207 . . . . 0.0 112.544 -179.962 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.64 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 20.7 tptm . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.828 0.347 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.069 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -135.9 -168.95 2.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.8 ' O ' ' HD2' ' A' ' 9' ' ' LYS . 73.6 t -145.67 72.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.932 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 1.079 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -43.92 162.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.251 0.548 . . . . 0.0 111.09 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.8 ' HD2' ' O ' ' A' ' 7' ' ' VAL . 0.0 OUTLIER -149.82 -22.42 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.343 179.095 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.666 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 54.8 t30 -156.5 165.52 36.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.265 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.666 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 166.54 127.97 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.985 0.422 . . . . 0.0 111.911 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.772 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 2.1 m-20 -118.36 26.93 9.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.872 178.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.888 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 28.6 ttp -108.91 167.04 10.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.823 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.678 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.1 OUTLIER -58.14 129.4 41.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.79 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.674 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 mt-10 -33.74 -66.72 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -50.55 -32.92 19.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.785 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.691 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 39.5 mmm -72.63 -33.72 66.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.17 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.802 ' HA ' HD13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.49 -39.41 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.636 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.641 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 1.8 mt-30 -74.48 -34.3 63.08 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.24 -31.79 66.13 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.848 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.742 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -67.34 -46.45 73.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.18 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.76 HG12 ' CD2' ' A' ' 76' ' ' PHE . 11.8 t -59.67 -45.16 94.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.541 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 43.0 mt-10 -59.64 -37.0 77.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.117 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.616 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 11.5 t -66.32 -40.22 89.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.159 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.734 ' HA ' HD12 ' A' ' 42' ' ' ILE . . . -67.49 -22.59 65.45 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.676 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 2.3 m -78.85 -46.39 18.72 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.581 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.558 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 7.4 mm100 -48.06 -45.23 32.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.417 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.919 ' HB2' HG21 ' A' ' 38' ' ' ILE . . . -77.47 -33.84 54.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.127 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.691 ' CD1' ' HG ' ' A' ' 78' ' ' LEU . 5.5 mt -63.75 -24.02 67.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.055 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -99.43 -28.65 13.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.554 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.785 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 29.5 mmtp -84.87 -27.27 26.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 111.091 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.785 ' CE1' ' HB2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -146.25 161.31 40.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -126.31 36.38 4.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.866 HG21 ' HD3' ' A' ' 36' ' ' LYS . 3.3 mm -120.15 97.43 5.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.829 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.66 ' C ' ' HA3' ' B' ' 63' ' ' GLY . 2.5 mp0 -22.5 -72.71 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.206 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.866 ' HD3' HG21 ' A' ' 34' ' ' ILE . 0.0 OUTLIER -47.62 -51.04 22.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.5 179.617 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.855 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.6 t0 -54.38 -62.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.52 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.919 HG21 ' HB2' ' A' ' 28' ' ' ALA . 5.6 mt -43.51 -42.82 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.874 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.686 ' HB1' ' HB2' ' B' ' 65' ' ' TYR . . . -65.6 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.902 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.809 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -39.1 -51.39 1.88 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.938 0.399 . . . . 0.0 110.724 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.591 ' HD1' ' HB1' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -64.91 -54.91 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.89 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.832 HD11 HG22 ' A' ' 38' ' ' ILE . 83.9 mt -45.72 -56.42 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.098 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.516 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -59.47 -70.9 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.966 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.537 ' HD2' ' C ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -34.1 -59.97 0.41 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.959 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -46.76 84.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.941 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.742 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -59.76 -18.58 44.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.817 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.72 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -87.84 -34.27 18.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.636 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -99.56 6.72 45.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.755 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.97 6.68 8.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.102 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.598 ' CD1' ' HE3' ' A' ' 17' ' ' MET . 95.2 m-85 -149.1 -67.3 0.22 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.738 ' O ' ' HE2' ' A' ' 87' ' ' LYS . 12.3 m-20 160.93 108.52 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.432 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.72 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 92.0 Cg_exo -43.85 155.76 0.19 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.47 2.113 . . . . 0.0 112.437 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.803 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.5 m -117.2 132.61 56.6 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 123.199 0.6 . . . . 0.0 110.485 -0.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.818 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 60.6 m95 -98.81 166.89 11.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.415 0.626 . . . . 0.0 111.951 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.87 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.0 OUTLIER -158.03 109.26 2.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.237 179.269 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.783 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 6.2 p -121.96 152.05 40.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.223 0.535 . . . . 0.0 112.425 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.989 HG13 HD11 ' B' ' 57' ' ' ILE . 20.9 mm -129.13 105.93 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.391 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.66 HG11 ' HB ' ' A' ' 38' ' ' ILE . 5.6 p -104.13 124.33 58.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.915 0.388 . . . . 0.0 111.675 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.725 ' O ' HG11 ' A' ' 81' ' ' VAL . . . -149.65 -131.45 1.94 Allowed Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.758 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.613 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -160.02 5.64 0.09 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.657 0.265 . . . . 0.0 111.475 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.613 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 41.8 t30 166.7 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.763 0.315 . . . . 0.0 111.312 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.748 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 45.9 p90 -77.5 -178.33 5.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.0 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.602 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.94 76.94 0.39 Allowed Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.177 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.768 ' HA ' HG12 ' B' ' 57' ' ' ILE . 88.6 p -69.98 151.97 44.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.881 0.372 . . . . 0.0 111.354 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.954 ' HB2' ' HB2' ' B' ' 39' ' ' ALA . 11.6 t80 -164.22 56.81 0.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.589 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.808 HG13 ' CZ ' ' A' ' 86' ' ' PHE . 6.9 m -80.83 -161.12 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.049 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.599 HG21 ' OG1' ' B' ' 53' ' ' THR . 1.2 m -157.03 96.47 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.221 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.628 ' CD2' ' N ' ' A' ' 69' ' ' GLU . 42.6 t60 -175.68 -97.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.846 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.628 ' N ' ' CD2' ' A' ' 68' ' ' HIS . 0.6 OUTLIER 43.75 75.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.973 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -101.99 -37.27 8.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.984 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.772 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 4.3 ptpt -177.67 12.18 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.941 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.911 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 61.6 m-70 -136.97 23.99 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.822 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.833 ' HD2' ' HB3' ' A' ' 86' ' ' PHE . 14.1 t80 -105.63 168.8 8.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.852 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.802 HD13 ' HA ' ' A' ' 18' ' ' GLN . 1.4 tt 171.54 119.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.124 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.403 ' O ' ' HD3' ' A' ' 9' ' ' LYS . 3.5 t80 -116.52 111.33 19.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.809 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 1.079 ' HB3' HG13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -130.98 176.46 8.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.221 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.709 ' CB ' ' HE2' ' A' ' 9' ' ' LYS . 20.2 t80 -135.93 103.97 5.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.756 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.069 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -61.41 177.66 0.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.916 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.83 -42.03 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.46 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.516 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 2.2 pm0 -154.53 43.04 0.5 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.862 0.363 . . . . 0.0 110.829 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.863 HG12 ' N ' ' A' ' 82' ' ' ALA . 55.6 t -154.49 166.85 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.116 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.863 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -134.68 114.48 12.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.673 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.649 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -105.71 120.4 56.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.998 0.428 . . . . 0.0 111.429 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.783 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -105.06 91.78 3.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.316 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.716 HD11 ' CB ' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -95.86 127.11 41.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -179.282 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.833 ' HB3' ' HD2' ' A' ' 73' ' ' PHE . 30.0 p90 -158.06 144.48 17.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.742 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.911 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -105.14 -170.23 1.72 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.957 0.408 . . . . 0.0 110.771 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.87 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 121.471 0.653 . . . . 0.0 109.994 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.756 ' HG2' ' CD ' ' B' ' 19' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.877 0.37 . . . . 0.0 110.815 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.723 ' O ' HD11 ' B' ' 78' ' ' LEU . 0.0 OUTLIER -80.44 118.67 22.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.029 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 162.1 -167.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.116 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.983 HG12 ' HE2' ' B' ' 9' ' ' LYS . 22.7 t -156.67 73.24 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.968 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -47.24 148.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.06 0.457 . . . . 0.0 110.535 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.983 ' HE2' HG12 ' B' ' 7' ' ' VAL . 2.8 mmtt -154.68 -1.95 0.17 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.324 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.905 ' HB3' ' HB3' ' B' ' 75' ' ' TYR . 0.3 OUTLIER -164.08 70.3 0.2 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.963 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.754 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -110.73 153.81 24.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.133 0.492 . . . . 0.0 111.511 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.605 ' HB3' ' HD2' ' B' ' 68' ' ' HIS . 6.9 t70 -149.85 28.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.015 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.908 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 11.9 ttp -121.48 170.82 9.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.66 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.747 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.3 OUTLIER -57.19 140.86 48.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.716 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.701 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 31.5 mp0 -46.0 -63.39 0.99 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.172 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -28.69 19.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.004 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.908 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 53.4 mmm -79.63 -35.56 39.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.048 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.73 ' HG2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -71.17 -35.67 71.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.921 0.391 . . . . 0.0 110.315 179.657 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.756 ' CD ' ' HG2' ' B' ' 4' ' ' ARG . 2.6 mm-40 -75.16 -36.56 61.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.182 0.515 . . . . 0.0 109.646 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.544 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 5.4 m-20 -70.35 -29.28 65.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.653 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.826 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -68.92 -49.22 59.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.905 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.806 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 77.6 t -54.28 -45.29 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.139 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 83.6 mt-10 -58.94 -39.6 82.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.878 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 13.3 t -65.22 -36.23 83.52 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.009 -0.542 . . . . 0.0 109.968 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 1.024 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -69.26 -29.56 67.49 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.802 ' HA ' HD13 ' B' ' 29' ' ' LEU . 2.0 m -71.45 -37.69 71.36 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.825 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.483 ' HB2' ' HE2' ' B' ' 41' ' ' HIS . 43.1 mt-30 -60.72 -42.73 97.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.692 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.94 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -73.42 -27.2 61.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.583 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.802 HD13 ' HA ' ' B' ' 26' ' ' THR . 2.5 mt -72.98 -49.19 30.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.87 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.75 -26.64 63.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.024 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.629 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 2.6 mttp -86.73 -30.32 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.966 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.695 ' HH ' ' HD1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.6 163.91 36.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.005 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.42 27.75 6.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.75 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.682 ' HB ' ' CB ' ' B' ' 37' ' ' ASP . 9.2 mm -108.78 106.39 20.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.797 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.633 ' OE2' ' HA2' ' B' ' 59' ' ' GLY . 2.0 mm-40 -29.78 -71.03 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.502 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -46.82 -48.05 20.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.869 0.366 . . . . 0.0 110.609 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.682 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 14.3 t0 -54.77 -60.81 2.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.648 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.94 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 3.9 mt -48.13 -49.1 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.516 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.954 ' HB2' ' HB2' ' A' ' 65' ' ' TYR . . . -56.6 -35.5 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.43 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.791 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -72.04 -63.64 1.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.317 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.732 ' CD2' ' HB3' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -37.47 -56.13 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.14 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.755 HG12 ' HA ' ' B' ' 25' ' ' ALA . 6.9 mt -56.56 -68.24 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.284 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.638 ' HE3' ' HE2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -38.94 -47.84 1.5 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.827 0.346 . . . . 0.0 111.146 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.508 ' N ' ' HD2' ' B' ' 43' ' ' LYS . 0.4 OUTLIER -61.91 -53.11 60.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.462 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.514 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 1.2 tp10 -60.83 -34.21 74.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.164 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.826 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -67.06 -49.04 66.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.821 0.343 . . . . 0.0 110.606 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.647 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -55.73 -37.66 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.86 -20.2 22.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.383 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.514 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 3.0 tttt -88.5 -13.35 40.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 111.18 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.64 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 23.3 m-85 -142.49 -67.54 0.37 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.418 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.64 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 30.8 t-20 160.22 117.32 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.827 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.647 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 10.7 Cg_endo -53.28 168.96 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.442 2.095 . . . . 0.0 112.511 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.706 HG22 ' O ' ' B' ' 53' ' ' THR . 8.6 t -109.99 122.45 47.61 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 122.833 0.453 . . . . 0.0 110.775 0.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.831 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 48.5 m95 -92.44 120.8 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.704 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.667 ' HE2' HG22 ' B' ' 53' ' ' THR . 0.2 OUTLIER -100.0 105.44 17.11 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.116 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.731 ' CB ' HD11 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -130.8 165.28 23.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.52 0.676 . . . . 0.0 112.183 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.989 HD11 HG13 ' A' ' 57' ' ' ILE . 34.3 mt -146.44 165.41 8.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.589 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.882 ' H ' HG21 ' B' ' 57' ' ' ILE . 1.7 p -155.14 122.35 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 111.596 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.633 ' HA2' ' OE2' ' B' ' 35' ' ' GLU . . . -149.2 -175.02 21.23 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.037 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.65 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.9 OUTLIER -146.3 36.18 1.0 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.218 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.65 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.2 OUTLIER 168.11 26.6 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.121 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.791 ' CE2' ' HB3' ' B' ' 64' ' ' SER . 0.1 OUTLIER -111.48 -166.57 1.09 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.66 ' HA3' ' C ' ' A' ' 35' ' ' GLU . . . -144.8 77.79 0.27 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.843 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.938 ' HA ' HD12 ' A' ' 57' ' ' ILE . 18.1 p -70.6 131.77 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.034 0.445 . . . . 0.0 111.531 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.809 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 55.7 t80 -144.76 76.51 1.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.304 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.951 HG11 HD11 ' A' ' 57' ' ' ILE . 28.5 m -110.2 167.39 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.235 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.509 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 28.7 m -112.8 134.98 54.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.875 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.605 ' HD2' ' HB3' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -87.36 176.63 7.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.834 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.599 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -162.61 56.81 0.22 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.827 -179.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.668 HG23 ' H ' ' B' ' 71' ' ' LYS . 2.0 t 169.37 -108.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.947 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.668 ' H ' HG23 ' B' ' 70' ' ' THR . 0.0 OUTLIER -163.26 28.94 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.606 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.919 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 7.3 m80 -128.75 41.96 3.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.983 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.758 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 12.9 t80 -117.59 83.65 2.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.357 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.787 HD13 HD11 ' B' ' 8' ' ' ILE . 0.0 OUTLIER -110.94 109.5 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.922 -179.155 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.905 ' HB3' ' HB3' ' B' ' 10' ' ' ASN . 14.1 t80 -99.33 126.02 45.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.315 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.968 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.7 p90 -142.92 170.24 16.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.007 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.64 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 50.9 t80 -132.9 116.94 17.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.621 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.029 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -69.13 167.64 15.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.679 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -29.12 -46.9 0.08 OUTLIER Glycine 0 C--N 1.329 0.145 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.945 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.56 ' C ' HG22 ' B' ' 81' ' ' VAL . 2.8 tt0 -143.32 27.63 1.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' B' ' 78' ' ' LEU . 38.3 t -145.41 171.03 5.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.894 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.732 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -132.34 145.52 51.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.882 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 1.024 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -142.97 106.42 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.153 -179.741 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.735 ' HG ' ' O ' ' B' ' 84' ' ' LEU . 0.2 OUTLIER -97.97 110.17 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.575 179.741 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.758 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 2.0 mp -106.88 125.21 50.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.9 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.725 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.7 OUTLIER -151.58 119.07 6.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.364 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.919 ' HB2' ' HB2' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -97.01 164.27 12.59 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.758 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.599 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -119.23 18.98 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.341 0.591 . . . . 0.0 110.649 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . 0.491 ' HA2' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.339 -1.256 . . . . 0.0 112.467 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.713 ' O ' ' HB1' ' A' ' 6' ' ' ALA . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.617 0.246 . . . . 0.0 110.75 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.033 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 159.15 172.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.693 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.761 ' O ' ' HE2' ' A' ' 9' ' ' LYS . 8.7 t -131.03 69.37 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.847 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -33.48 149.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.761 ' HE2' ' O ' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -134.84 -12.71 2.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.8 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 177.51 93.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.638 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.822 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -129.72 104.13 7.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.723 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.517 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 16.8 m-20 -96.01 27.71 3.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.234 0.54 . . . . 0.0 109.866 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.99 ' HE2' HG23 ' A' ' 74' ' ' ILE . 0.9 OUTLIER -103.79 168.96 8.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.783 -179.622 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.887 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -51.32 123.59 9.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.466 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -34.86 -69.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.824 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.509 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 32.6 tt0 -52.15 -28.38 17.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.899 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -71.85 -41.6 67.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.856 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.722 ' HA ' HD13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.42 -29.51 69.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.944 0.402 . . . . 0.0 110.331 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.759 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -77.21 -42.32 37.87 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.097 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.759 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -69.29 -28.4 66.25 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.555 178.986 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.801 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 30.0 t -67.11 -51.12 58.07 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.969 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.765 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 94.1 t -54.41 -46.59 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.926 179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -54.34 -43.62 71.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.351 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -39.27 91.76 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.951 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.847 ' HB2' HG21 ' A' ' 83' ' ' ILE . . . -69.39 -30.97 69.07 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.572 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -70.68 -37.08 73.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.58 178.499 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.448 HE21 ' HB3' ' A' ' 27' ' ' GLN . 6.0 mt-30 -58.81 -42.4 89.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.971 ' HB2' HG23 ' A' ' 38' ' ' ILE . . . -79.84 -23.03 42.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.289 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.83 HD13 ' HG ' ' A' ' 78' ' ' LEU . 4.6 mt -81.1 -26.13 36.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.022 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.23 -32.47 15.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.201 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.511 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -86.08 -24.94 26.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.783 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.628 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -150.11 155.86 40.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.614 179.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.54 28.53 6.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.063 0.458 . . . . 0.0 110.735 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.852 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 16.1 mm -106.59 107.54 22.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.942 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.759 ' HB3' ' CA ' ' B' ' 63' ' ' GLY . 0.9 OUTLIER -26.67 -84.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.033 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.01 -47.31 2.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.323 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.852 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -54.75 -63.11 1.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 0.0 111.14 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.971 HG23 ' HB2' ' A' ' 28' ' ' ALA . 3.2 mt -48.2 -48.21 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.901 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -59.86 -42.1 92.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.05 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.787 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.4 -64.67 0.77 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.077 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.611 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -52.29 -39.53 60.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.659 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.719 HD12 ' CG2' ' A' ' 38' ' ' ILE . 85.4 mt -58.56 -57.22 11.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.958 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.578 ' HD2' ' HG1' ' B' ' 67' ' ' THR . 0.2 OUTLIER -51.57 -60.51 3.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -42.57 -62.23 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.602 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.3 mt-10 -42.98 -67.48 0.27 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.946 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.801 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -44.57 -51.32 9.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.729 ' OD1' ' HB2' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -57.54 -25.02 59.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.087 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -120.97 14.27 11.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.18 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.5 tttp -128.44 1.89 5.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.389 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.507 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 72.2 m-85 -152.85 -62.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.185 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.482 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 3.1 m-20 161.24 117.67 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.566 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.579 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 19.1 Cg_endo -60.06 169.18 5.07 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.521 2.147 . . . . 0.0 112.327 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.776 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 88.6 m -104.92 130.58 53.06 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.011 0.525 . . . . 0.0 110.254 -0.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.729 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 69.1 m95 -101.51 170.56 8.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.654 0.74 . . . . 0.0 112.421 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.683 ' HE2' ' N ' ' A' ' 88' ' ' SER . 0.3 OUTLIER -162.92 103.64 1.01 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.442 179.495 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 1.094 ' HB3' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -117.97 156.12 29.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.538 0.685 . . . . 0.0 112.796 -177.667 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.922 HD13 ' H ' ' B' ' 65' ' ' TYR . 27.0 mm -127.45 157.52 39.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.144 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.776 HG11 ' N ' ' A' ' 39' ' ' ALA . 4.1 p -152.36 112.12 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.888 0.375 . . . . 0.0 111.276 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.608 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -150.75 -155.86 7.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.157 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.474 ' HB2' HH11 ' A' ' 60' ' ' ARG . 0.1 OUTLIER -163.5 34.72 0.09 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 120.76 0.314 . . . . 0.0 111.289 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 171.05 26.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.785 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 24.0 p90 -111.12 179.95 3.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.802 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.854 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -135.4 96.29 0.27 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.321 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 1.028 ' HA ' HD11 ' B' ' 57' ' ' ILE . 4.7 p -82.03 129.82 34.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.061 0.458 . . . . 0.0 111.54 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.791 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 67.3 t80 -143.49 84.18 1.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.118 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.921 HG13 HD13 ' B' ' 57' ' ' ILE . 4.4 m -135.81 159.85 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.306 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.806 HG21 ' CE1' ' B' ' 55' ' ' HIS . 1.3 t -66.75 -171.98 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.034 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.623 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -129.05 172.69 11.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.011 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.725 ' CG ' ' HA ' ' A' ' 88' ' ' SER . 7.1 mm-40 -163.85 143.85 8.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.885 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.736 HG22 ' HG2' ' A' ' 71' ' ' LYS . 48.3 m 47.64 -102.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.861 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 19.6 mmtt -74.06 32.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.742 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.74 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 53.7 m-70 48.77 -87.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.74 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 2.3 p90 163.51 156.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.786 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.99 HG23 ' HE2' ' A' ' 13' ' ' MET . 0.7 OUTLIER -127.96 106.21 14.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 111.024 179.566 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.744 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 63.4 t80 -106.72 93.82 4.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.847 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -107.69 168.59 9.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.331 -179.534 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.64 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 76.7 t80 -127.0 87.39 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.716 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.033 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -40.67 167.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.465 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.38 -48.58 0.33 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.759 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.25 20.6 2.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.632 HG13 ' N ' ' A' ' 82' ' ' ALA . 39.9 t -140.7 175.12 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.708 ' O ' ' HA ' ' A' ' 58' ' ' VAL . . . -137.14 143.45 42.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.661 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.847 HG21 ' HB2' ' A' ' 25' ' ' ALA . 0.2 OUTLIER -132.45 111.49 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 -179.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.904 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 3.9 tp -94.93 88.81 5.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.417 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 1.094 HD13 ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -93.65 141.0 28.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.458 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.656 ' CB ' ' HB2' ' A' ' 73' ' ' PHE . 2.8 p90 -176.51 152.23 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.861 ' HZ3' ' HG2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -112.43 -168.46 1.32 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.841 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.725 ' HA ' ' CG ' ' A' ' 69' ' ' GLU . 41.8 m . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.297 0.57 . . . . 0.0 110.517 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.437 ' NH1' ' HB2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.781 0.324 . . . . 0.0 110.89 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.764 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.8 OUTLIER 46.08 31.01 1.04 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.002 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.002 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.79 -177.94 4.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.27 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.638 HG11 ' HE2' ' B' ' 9' ' ' LYS . 72.9 t -141.85 68.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.553 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.901 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -38.58 150.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 -179.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.638 ' HE2' HG11 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -137.92 -15.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.991 179.497 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.5 OUTLIER -175.92 122.73 0.19 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.417 -179.864 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.665 ' HB3' HG13 ' B' ' 74' ' ' ILE . . . -149.03 102.08 3.22 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.788 0.328 . . . . 0.0 111.821 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.705 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -84.62 26.79 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.291 0.567 . . . . 0.0 109.857 178.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.865 ' HG2' ' N ' ' B' ' 14' ' ' SER . 0.1 OUTLIER -114.66 166.76 11.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.544 -179.586 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.865 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.3 OUTLIER -55.33 141.37 36.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.744 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.644 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -51.58 -56.59 12.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -28.73 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.686 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.74 ' HA ' ' OD2' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -75.56 -39.51 58.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.851 179.85 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.769 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -66.42 -29.25 69.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.052 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -77.55 -45.15 26.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.095 0.474 . . . . 0.0 109.818 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.74 ' OD2' ' HA ' ' B' ' 17' ' ' MET . 2.2 p30 -70.97 -27.72 63.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.741 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.888 ' HG ' HG22 ' B' ' 74' ' ' ILE . 96.2 p -68.88 -44.27 73.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.232 179.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.812 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 40.6 t -62.67 -47.32 93.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.564 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -58.73 -35.05 72.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.69 -37.24 79.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.006 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.892 ' HB1' HG23 ' B' ' 83' ' ' ILE . . . -70.08 -31.14 68.57 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.683 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 23.8 m -71.0 -42.34 69.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.295 -1.321 . . . . 0.0 109.505 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.519 ' O ' ' HG3' ' B' ' 30' ' ' GLU . 1.7 mt-30 -51.97 -46.44 64.8 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.316 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.768 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -77.24 -19.83 56.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.172 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.739 HD11 ' C ' ' B' ' 25' ' ' ALA . 5.2 mt -78.71 -25.22 44.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.938 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 1.2 pt-20 -90.28 -38.39 13.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.172 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.838 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.2 mmtp -77.52 -33.48 54.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.614 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.838 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -143.4 146.38 33.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.812 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.585 ' OD1' HD11 ' B' ' 34' ' ' ILE . 26.2 p30 -113.52 30.22 7.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.899 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 14.6 mm -106.78 105.98 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.676 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.854 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.3 mp0 -29.52 -67.48 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.74 ' HZ1' ' HB2' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -52.71 -56.96 11.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.886 0.374 . . . . 0.0 110.719 179.625 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.899 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.7 t0 -45.55 -65.43 0.54 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.743 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.768 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 8.2 mt -43.76 -58.94 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.114 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.868 ' HB3' HG12 ' B' ' 58' ' ' VAL . . . -45.96 -52.83 11.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.952 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.791 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -47.84 -66.11 0.46 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.967 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.558 ' CE1' ' CD1' ' B' ' 32' ' ' TYR . 0.2 OUTLIER -45.86 -43.64 13.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.942 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.705 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 67.1 mt -54.85 -62.84 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.788 ' HD3' ' CE2' ' A' ' 65' ' ' TYR . 12.0 tttm -50.48 -37.28 37.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.752 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.73 ' HZ2' ' HB3' ' B' ' 44' ' ' LYS . 0.3 OUTLIER -64.2 -46.99 81.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.093 -179.811 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.704 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 26.3 tt0 -73.25 -28.83 62.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.778 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -77.49 -36.17 52.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.741 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 4.0 m-20 -74.92 -30.49 61.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.098 0.475 . . . . 0.0 110.221 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -87.08 -40.78 14.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.753 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.704 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.9 ttmt -76.6 -27.34 55.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 -179.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.658 ' CD2' ' HE3' ' B' ' 17' ' ' MET . 16.7 m-85 -121.02 -68.52 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.339 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.497 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER 155.86 119.47 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 -179.523 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.741 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 19.7 Cg_endo -58.53 168.31 4.16 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 122.375 2.05 . . . . 0.0 112.645 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.705 HG21 ' HE2' ' B' ' 55' ' ' HIS . 15.1 t -106.91 133.16 51.99 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.229 0.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.878 ' NE1' ' HE3' ' B' ' 87' ' ' LYS . 39.5 m95 -103.86 110.14 22.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.418 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.806 ' CE1' HG21 ' A' ' 67' ' ' THR . 3.5 m170 -82.57 95.62 7.82 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.558 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 24.5 p -110.43 133.93 52.81 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 1.028 HD11 ' HA ' ' A' ' 64' ' ' SER . 17.6 mm -125.15 115.23 43.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.704 178.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.868 HG12 ' HB3' ' B' ' 39' ' ' ALA . 2.5 p -116.87 119.13 61.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.024 0.44 . . . . 0.0 111.691 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.771 ' O ' HG12 ' B' ' 81' ' ' VAL . . . -137.17 -125.98 2.47 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.809 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.417 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.7 OUTLIER -165.15 -6.1 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.671 0.272 . . . . 0.0 111.464 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.429 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 14.2 t-20 179.26 37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.856 0.36 . . . . 0.0 111.077 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.785 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.4 p90 -88.62 179.85 6.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.759 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -125.28 74.98 0.4 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.981 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.977 ' HB2' HD23 ' B' ' 84' ' ' LEU . 65.4 p -71.26 135.26 47.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.965 0.412 . . . . 0.0 111.514 -179.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.922 ' H ' HD13 ' A' ' 57' ' ' ILE . 18.4 t80 -146.83 71.16 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.458 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.89 HG11 HD12 ' A' ' 57' ' ' ILE . 17.9 m -104.59 163.73 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.097 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.578 ' HG1' ' HD2' ' A' ' 43' ' ' LYS . 20.0 m -103.02 103.94 14.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.15 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.546 ' HD2' ' CB ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -70.74 -158.36 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.545 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.4 OUTLIER 177.33 -87.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.056 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.479 ' O ' ' O ' ' B' ' 69' ' ' GLU . 2.0 m -37.97 -99.2 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.281 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.589 ' NZ ' ' HB3' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 179.16 44.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.903 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.704 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 36.6 m80 -135.48 42.52 2.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.877 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.705 ' HD1' ' H ' ' B' ' 12' ' ' ASP . 2.7 t80 -113.6 106.83 14.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.419 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.888 HG22 ' HG ' ' B' ' 21' ' ' SER . 0.7 OUTLIER -121.81 144.83 29.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.641 -179.797 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.807 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -133.95 133.35 41.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.006 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.901 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.08 163.55 36.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.577 -179.344 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.675 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 11.5 t80 -120.79 105.25 10.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.737 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.002 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.3 mm? -69.86 170.77 10.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.605 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.73 -35.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.898 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.599 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -159.54 43.41 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.787 0.327 . . . . 0.0 110.854 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.894 HG13 HD13 ' B' ' 83' ' ' ILE . 54.2 t -158.92 167.1 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.235 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.637 ' H ' HG12 ' B' ' 81' ' ' VAL . . . -140.8 101.14 4.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.707 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.894 HD13 HG13 ' B' ' 81' ' ' VAL . 0.3 OUTLIER -84.61 150.06 4.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.374 -179.64 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.977 HD23 ' HB2' ' B' ' 64' ' ' SER . 1.6 tp -135.64 84.88 2.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.757 HD22 ' CE2' ' B' ' 46' ' ' PHE . 0.4 OUTLIER -87.91 137.46 32.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 110.948 179.816 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.718 ' CD2' HG23 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -171.64 124.23 0.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.897 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.878 ' HE3' ' NE1' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -96.62 149.35 21.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.794 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -109.97 20.41 17.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.302 0.572 . . . . 0.0 110.566 179.809 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.429 -1.206 . . . . 0.0 112.508 -179.987 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.445 ' O ' HD11 ' A' ' 78' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.783 0.325 . . . . 0.0 111.378 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.1 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.18 -169.61 2.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.217 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.663 HG11 ' HE3' ' A' ' 9' ' ' LYS . 15.1 t -147.89 72.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.87 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.79 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.9 135.82 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.029 0.442 . . . . 0.0 110.355 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.663 ' HE3' HG11 ' A' ' 7' ' ' VAL . 8.5 mmpt? -113.59 -18.59 11.89 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.544 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.663 ' O ' ' HB1' ' A' ' 11' ' ' ALA . 0.7 OUTLIER -176.06 158.62 2.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.682 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.767 ' HB2' ' HA ' ' A' ' 74' ' ' ILE . . . 169.03 138.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.998 0.427 . . . . 0.0 111.685 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.786 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER -123.65 28.96 6.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.464 179.461 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.721 ' HG3' ' H ' ' A' ' 14' ' ' SER . 15.8 ttp -104.44 170.44 7.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.842 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.721 ' H ' ' HG3' ' A' ' 13' ' ' MET . 22.7 t -56.41 129.35 40.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.699 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.633 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.0 mm-40 -36.72 -67.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.47 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -48.58 -29.51 4.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.802 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.64 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.54 -31.91 62.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.791 179.799 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.682 ' NE2' ' HB3' ' A' ' 13' ' ' MET . 0.0 OUTLIER -72.83 -39.07 66.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.586 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.596 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 93.0 mt-30 -77.46 -34.09 54.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.763 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.0 OUTLIER -71.49 -36.25 71.07 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.603 179.12 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.817 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 1.2 p -64.34 -50.15 68.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.942 179.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.725 HG23 HD12 ' A' ' 8' ' ' ILE . 16.4 t -54.98 -45.15 76.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.338 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.659 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 11.8 mt-10 -56.07 -41.05 74.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.35 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.63 -39.44 93.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.141 0.496 . . . . 0.0 110.027 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.742 ' C ' HD13 ' A' ' 29' ' ' LEU . . . -69.22 -30.89 69.15 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -70.75 -36.95 73.37 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.498 178.543 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.669 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 22.2 mt-30 -59.52 -41.62 90.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.478 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.911 ' HB3' ' HA ' ' A' ' 38' ' ' ILE . . . -83.04 -22.57 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.688 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.742 HD13 ' C ' ' A' ' 25' ' ' ALA . 4.3 mt -76.28 -36.13 58.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.992 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.08 -29.65 19.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.837 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.669 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 20.6 mttt -83.63 -20.84 32.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.627 ' CG ' ' HE1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -146.31 -172.52 3.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.586 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.09 27.48 0.36 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.103 0.478 . . . . 0.0 110.542 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 1.046 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 18.9 mm -114.57 104.64 17.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.772 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.628 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 3.5 mp0 -25.39 -77.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.393 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.497 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -46.17 -45.14 16.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.193 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 1.046 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -57.97 -60.14 4.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.936 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.911 ' HA ' ' HB3' ' A' ' 28' ' ' ALA . 4.3 mt -51.75 -54.78 11.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.985 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.799 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -53.78 -39.38 65.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.043 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.736 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.9 -63.12 1.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.123 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.627 ' HE1' ' CG ' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -54.76 -49.03 71.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.822 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.864 HG22 HD12 ' A' ' 85' ' ' LEU . 73.3 mt -44.39 -58.85 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.091 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.728 ' HE3' ' CE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -60.26 -61.61 2.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.682 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.555 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 10.6 mttt -36.71 -66.31 0.23 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.004 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.731 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mm-40 -49.16 -42.6 40.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.91 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.817 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -61.9 -42.71 99.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.165 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.733 ' HA ' ' CD1' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -65.55 -24.11 67.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.845 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.92 8.92 16.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.461 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.731 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 7.4 tttm -118.17 -1.52 11.35 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.716 ' CE1' ' HB3' ' A' ' 49' ' ' LYS . 10.9 m-85 -150.52 -62.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.363 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.68 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 17.3 t-20 164.82 115.46 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.291 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.728 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 18.9 Cg_endo -60.03 168.82 5.45 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.339 2.026 . . . . 0.0 112.593 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.786 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.9 m -101.82 137.34 40.25 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 110.3 0.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.824 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 76.5 m95 -106.12 140.42 39.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.517 0.675 . . . . 0.0 112.039 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.837 ' HE2' ' HB2' ' A' ' 88' ' ' SER . 0.4 OUTLIER -132.18 107.82 8.86 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.923 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.887 ' HB3' HD11 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -127.87 175.08 8.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.388 0.614 . . . . 0.0 112.198 -177.922 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.935 HG12 ' HA ' ' B' ' 64' ' ' SER . 60.8 mt -155.39 165.1 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.713 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.828 ' H ' HG21 ' A' ' 57' ' ' ILE . 7.5 p -151.55 119.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.942 0.401 . . . . 0.0 110.984 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.483 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -143.91 -174.49 16.22 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.113 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.789 ' HG3' HH11 ' A' ' 60' ' ' ARG . 0.4 OUTLIER -150.88 30.06 0.65 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.825 0.345 . . . . 0.0 111.014 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.694 ' ND2' ' NH1' ' B' ' 60' ' ' ARG . 0.7 OUTLIER 172.14 27.5 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.789 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -111.07 -168.21 1.27 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.738 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -142.13 78.59 0.28 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.855 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.97 ' HA ' HD13 ' B' ' 57' ' ' ILE . 5.8 p -72.23 128.54 35.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.992 0.425 . . . . 0.0 111.231 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.816 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 33.0 t80 -143.45 83.59 1.78 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.415 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.99 HG11 ' HB3' ' B' ' 55' ' ' HIS . 2.9 m -127.42 155.85 38.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.453 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.699 HG21 ' HE2' ' B' ' 55' ' ' HIS . 1.2 t -63.75 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.488 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.783 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -148.02 112.76 5.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.847 0.356 . . . . 0.0 111.198 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.734 ' CB ' ' HA ' ' A' ' 88' ' ' SER . 38.9 mm-40 -97.43 174.08 6.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.747 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.572 ' C ' ' H ' ' A' ' 72' ' ' HIS . 0.2 OUTLIER 38.02 -119.19 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.688 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.506 ' H ' ' HB ' ' A' ' 70' ' ' THR . 3.1 mttt -71.16 30.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.904 0.383 . . . . 0.0 110.832 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.786 ' CG ' ' HB3' ' A' ' 12' ' ' ASP . 15.5 m-70 68.91 -88.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.008 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.793 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 162.55 -163.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.752 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.767 ' HA ' ' HB2' ' A' ' 11' ' ' ALA . 0.2 OUTLIER -169.64 111.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.617 179.515 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.445 ' CE1' ' OG ' ' A' ' 64' ' ' SER . 40.0 t80 -105.38 129.21 53.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.309 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.79 ' HB3' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -141.77 178.73 7.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.203 -179.849 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.839 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 5.3 t80 -140.18 102.75 4.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.1 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -67.88 -176.0 0.62 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.922 0.391 . . . . 0.0 111.043 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.555 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -55.82 88.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.278 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.618 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 2.5 mp0 80.07 10.64 1.23 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.777 0.322 . . . . 0.0 110.863 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.758 HG12 ' H ' ' A' ' 82' ' ' ALA . 4.4 t -136.22 177.49 6.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.248 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.839 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -148.55 159.7 43.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.752 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -146.21 117.23 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.915 0.388 . . . . 0.0 111.707 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.855 HD22 ' HE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -99.64 100.02 10.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.301 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 56' ' ' CYS . 0.5 OUTLIER -103.2 130.98 50.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.855 ' HE2' HD22 ' A' ' 84' ' ' LEU . 34.3 p90 -166.89 131.79 2.08 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.773 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.824 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 34.6 mtpt -86.2 -163.2 0.85 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.837 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.837 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 2.8 m . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 121.372 0.606 . . . . 0.0 110.366 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.828 ' N ' ' HD2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.826 0.346 . . . . 0.0 110.912 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.619 ' HA ' ' CE ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 42.61 28.06 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.599 -179.822 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.094 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.15 -164.71 1.35 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.932 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 77' ' ' TYR . 14.7 t -151.5 75.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.126 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.91 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -40.11 156.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.59 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.601 ' N ' HG21 ' B' ' 8' ' ' ILE . 0.0 OUTLIER -151.9 -8.84 0.21 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.526 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.559 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 0.1 OUTLIER -164.58 73.59 0.24 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.459 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.756 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -118.04 113.37 21.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.485 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.688 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 1.4 m-20 -114.29 32.58 5.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.379 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.877 ' HG2' ' N ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -116.65 170.02 8.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.677 -179.68 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.877 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -49.32 129.59 18.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.597 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 47.8 mt-10 -38.32 -70.43 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.035 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -48.64 -31.99 7.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.902 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.866 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -69.97 -38.59 76.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.882 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -67.31 -38.43 84.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.746 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.736 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 7.3 mm-40 -73.92 -35.83 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.772 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.598 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.5 OUTLIER -72.46 -30.81 64.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.806 179.189 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.846 ' HG ' HD13 ' B' ' 74' ' ' ILE . 0.4 OUTLIER -68.61 -42.36 78.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.294 179.487 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.8 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 12.5 t -66.95 -38.04 80.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.438 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.736 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 18.8 mt-10 -63.78 -39.11 93.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.081 179.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 73.0 m -68.72 -34.25 75.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.915 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.875 ' HB1' HG21 ' B' ' 83' ' ' ILE . . . -73.14 -33.77 65.69 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 1.046 ' HA ' HD12 ' B' ' 29' ' ' LEU . 53.8 m -70.53 -38.43 74.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.296 178.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -58.52 -42.06 86.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.356 178.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.907 ' HB3' HG22 ' B' ' 38' ' ' ILE . . . -67.67 -35.85 79.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.133 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 1.046 HD12 ' HA ' ' B' ' 26' ' ' THR . 1.1 mt -64.1 -38.86 92.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -30.62 59.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.175 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.523 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 1.0 OUTLIER -82.93 -29.48 29.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.875 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.598 ' HH ' ' HD1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.75 169.04 21.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.629 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.669 ' C ' HD12 ' B' ' 34' ' ' ILE . 11.3 t30 -129.09 30.51 5.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.124 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 1.02 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.8 mm -116.73 106.29 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.961 ' HA ' HD11 ' B' ' 38' ' ' ILE . 1.1 mp0 -29.61 -70.35 0.05 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.769 0.318 . . . . 0.0 110.667 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.12 -43.95 7.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.589 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 1.02 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -64.06 -59.56 4.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.451 179.634 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 1.006 ' HB ' HG13 ' B' ' 58' ' ' VAL . 1.0 OUTLIER -45.35 -53.74 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.665 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.754 ' HB3' ' HB2' ' A' ' 65' ' ' TYR . . . -49.83 -49.11 50.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.816 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -53.86 -68.23 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.807 ' CG ' ' HB2' ' B' ' 28' ' ' ALA . 0.2 OUTLIER -37.59 -40.92 0.43 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.45 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.76 HG12 ' HA ' ' B' ' 25' ' ' ALA . 56.9 mt -68.15 -67.66 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.555 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.679 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 6.0 tttp -39.87 -53.42 2.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.267 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.616 ' HE2' ' OH ' ' A' ' 65' ' ' TYR . 23.7 mttm -60.33 -43.98 95.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.415 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.769 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 50.0 tp10 -62.12 -37.2 84.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.296 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.782 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.36 -34.95 73.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.118 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.702 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.3 OUTLIER -68.73 -35.49 77.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.807 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.58 -23.52 21.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.138 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.769 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.97 -26.43 21.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.659 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 1.4 m-85 -127.94 -62.45 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.171 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.669 HD21 ' N ' ' B' ' 51' ' ' ASN . 0.0 OUTLIER 154.96 117.12 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.828 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.702 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 10.8 Cg_endo -53.92 169.45 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 122.351 2.034 . . . . 0.0 112.191 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.622 ' CG2' ' HB ' ' A' ' 67' ' ' THR . 5.8 m -111.37 124.92 53.24 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 122.866 0.467 . . . . 0.0 110.705 0.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.679 ' O ' ' HD2' ' B' ' 43' ' ' LYS . 33.6 m95 -97.53 146.75 24.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.723 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.99 ' HB3' HG11 ' A' ' 66' ' ' VAL . 10.5 m170 -111.07 98.79 7.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.108 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.792 ' SG ' HD12 ' B' ' 85' ' ' LEU . 43.6 t -103.58 124.05 48.08 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -177.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.97 HD13 ' HA ' ' A' ' 64' ' ' SER . 21.2 mm -121.92 102.54 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.127 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 1.006 HG13 ' HB ' ' B' ' 38' ' ' ILE . 2.6 p -107.24 121.87 60.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.678 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.743 ' O ' ' HB3' ' B' ' 60' ' ' ARG . . . -146.64 -97.24 0.2 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.05 -0.595 . . . . 0.0 111.773 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.756 ' HA ' ' HB1' ' B' ' 82' ' ' ALA . 7.8 ptt180 167.59 -27.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -158.6 46.69 0.32 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.667 0.27 . . . . 0.0 111.407 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.789 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 14.8 p90 -96.37 175.41 6.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.659 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.628 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -117.0 83.94 0.36 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.947 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.935 ' HA ' HG12 ' A' ' 57' ' ' ILE . 0.3 OUTLIER -75.73 133.12 40.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 111.432 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.882 ' H ' HG12 ' A' ' 57' ' ' ILE . 22.4 t80 -142.45 61.08 1.44 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.199 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.765 ' HB ' ' CZ ' ' B' ' 86' ' ' PHE . 33.2 m -108.6 168.65 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.678 -179.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.593 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 81.8 m -130.72 107.7 9.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.93 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.8 ' CE1' ' HG3' ' B' ' 87' ' ' LYS . 2.3 t-80 -63.92 -143.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.701 ' H ' ' ND1' ' B' ' 68' ' ' HIS . 0.0 OUTLIER 171.21 15.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.668 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.65 ' HB ' ' CE1' ' B' ' 68' ' ' HIS . 98.0 m -141.97 -96.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.082 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.808 ' HG2' ' HG3' ' B' ' 13' ' ' MET . 0.0 OUTLIER -87.31 14.69 7.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.268 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.692 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 47.7 m80 76.99 -78.84 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.699 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 12.4 p90 156.5 -169.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.34 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.882 HG13 ' HB3' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -157.35 114.11 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.021 0.439 . . . . 0.0 111.617 179.804 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.608 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 0.1 OUTLIER -102.27 137.24 40.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.236 179.435 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.91 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.4 OUTLIER -160.64 159.22 30.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.916 0.389 . . . . 0.0 111.307 -179.821 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.592 ' HB3' ' HE3' ' B' ' 9' ' ' LYS . 7.8 t80 -125.07 112.59 16.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.094 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -71.65 170.5 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.489 179.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.523 ' O ' ' HG3' ' B' ' 80' ' ' GLN . . . -24.44 -40.18 0.01 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 121.211 -0.518 . . . . 0.0 113.037 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' B' ' 78' ' ' LEU . 27.2 mt-30 -157.56 40.1 0.29 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.867 0.365 . . . . 0.0 110.803 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.742 HG12 ' O ' ' B' ' 59' ' ' GLY . 98.6 t -154.73 169.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.123 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.763 ' O ' HD12 ' B' ' 83' ' ' ILE . . . -132.36 151.96 51.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.331 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.875 HG21 ' HB1' ' B' ' 25' ' ' ALA . 0.2 OUTLIER -140.09 134.55 36.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.076 0.465 . . . . 0.0 111.589 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.717 HD21 HG12 ' B' ' 57' ' ' ILE . 0.3 OUTLIER -123.84 97.61 5.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.108 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.792 HD12 ' SG ' ' B' ' 56' ' ' CYS . 0.5 OUTLIER -100.85 131.62 46.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.975 0.417 . . . . 0.0 111.541 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.765 ' CZ ' ' HB ' ' B' ' 66' ' ' VAL . 0.4 OUTLIER -172.34 123.97 0.49 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.586 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.8 ' HG3' ' CE1' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -82.29 161.82 22.5 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.779 0.323 . . . . 0.0 110.721 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.696 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -107.57 19.12 20.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.231 0.538 . . . . 0.0 110.767 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . 0.473 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.427 -1.207 . . . . 0.0 112.412 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.537 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.886 0.374 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.122 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.5 173.9 9.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.369 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.716 HG11 ' HE3' ' A' ' 9' ' ' LYS . 47.9 t -123.92 71.49 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.726 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.865 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -41.37 162.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.077 -179.745 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.716 ' HE3' HG11 ' A' ' 7' ' ' VAL . 2.5 mmtt -155.12 -11.3 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -176.22 94.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.616 -179.859 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.894 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.32 84.95 2.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.637 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.703 ' H ' ' HD1' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -73.79 34.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.01 0.433 . . . . 0.0 110.407 179.4 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.793 ' HG3' ' H ' ' A' ' 14' ' ' SER . 12.1 ttp -127.69 170.4 12.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.948 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.793 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.3 OUTLIER -61.91 128.8 37.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.837 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.713 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -34.07 -78.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.15 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.419 ' OE1' ' HG2' ' A' ' 17' ' ' MET . 0.0 OUTLIER -37.21 -35.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.993 -179.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.72 ' HE2' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -70.87 -41.6 71.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.166 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.84 ' NE2' ' HB2' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -66.91 -35.33 79.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.59 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 4.1 mm100 -73.99 -37.92 64.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.139 0.495 . . . . 0.0 109.812 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.468 ' HB3' ' HH ' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -74.25 -31.02 62.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.022 179.372 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.769 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -67.8 -40.77 83.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.242 179.308 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.862 HG11 ' HB2' ' A' ' 6' ' ' ALA . 64.0 t -65.52 -50.8 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.59 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 13.3 mt-10 -53.61 -38.79 64.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -37.13 76.59 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.791 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.893 ' HA ' HD12 ' A' ' 42' ' ' ILE . . . -68.09 -25.12 65.16 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.718 ' HA ' HD11 ' A' ' 29' ' ' LEU . 4.2 m -74.93 -45.31 43.29 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.043 -1.435 . . . . 0.0 109.784 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.762 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 53.8 mt-30 -51.82 -47.37 64.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.85 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.706 ' HB2' ' HA ' ' A' ' 38' ' ' ILE . . . -74.42 -26.36 60.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.199 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.785 HD13 ' HG ' ' A' ' 78' ' ' LEU . 6.6 mt -67.15 -43.58 81.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.14 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -94.13 -10.84 31.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.12 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.762 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 3.7 mttp -85.01 -21.75 29.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 110.588 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.734 ' CE1' ' HB3' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -148.57 -54.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.452 179.374 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.54 ' HA ' HD13 ' A' ' 38' ' ' ILE . 1.8 t30 80.38 26.78 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.385 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.798 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -111.69 91.03 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.851 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.667 ' HG2' ' HA2' ' A' ' 59' ' ' GLY . 3.1 mp0 -14.05 -85.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 O-C-N 123.603 0.564 . . . . 0.0 111.685 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.49 -49.97 2.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.816 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.798 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -57.6 -60.1 4.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.641 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.706 ' HA ' ' HB2' ' A' ' 28' ' ' ALA . 51.7 mt -44.43 -51.86 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.91 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.729 ' HB1' HG12 ' A' ' 58' ' ' VAL . . . -55.9 -38.9 70.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.005 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.764 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -60.41 -66.36 0.54 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.868 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.583 ' HD1' ' HB2' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -50.86 -49.68 58.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.893 HD12 ' HA ' ' A' ' 25' ' ' ALA . 94.2 mt -50.24 -52.83 13.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.032 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.904 ' HE3' ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -61.75 -70.2 0.2 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.762 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -30.99 -50.31 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' A' ' 49' ' ' LYS . 3.6 mt-10 -63.84 -67.1 0.46 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.795 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.769 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -40.16 -39.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.783 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.761 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 9.8 t70 -68.29 -42.57 79.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.027 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -99.0 9.54 43.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.166 -179.789 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.56 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -117.32 -23.58 7.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.124 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.761 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 84.4 m-85 -120.79 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.272 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.761 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 13.7 t30 162.68 111.81 0.01 OUTLIER Pre-proline 0 N--CA 1.454 -0.245 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.094 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.761 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 81.8 Cg_exo -44.92 156.39 0.25 Allowed 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.372 2.048 . . . . 0.0 112.378 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.678 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 6.8 m -112.46 138.64 48.92 Favored 'General case' 0 C--N 1.345 0.41 0 C-N-CA 123.037 0.535 . . . . 0.0 110.511 -0.046 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.814 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 70.8 m95 -108.43 140.87 41.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.446 0.641 . . . . 0.0 112.488 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.881 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.1 OUTLIER -135.13 104.41 5.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.836 178.631 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.906 ' SG ' HD11 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -120.91 165.64 14.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.557 0.694 . . . . 0.0 112.79 -177.676 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.895 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 17.4 mm -132.51 165.21 32.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.601 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.752 ' H ' HG22 ' A' ' 57' ' ' ILE . 2.6 p -162.47 108.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.918 0.39 . . . . 0.0 111.541 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.734 ' O ' ' HB3' ' A' ' 60' ' ' ARG . . . -141.83 -114.62 1.08 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.734 ' HB3' ' O ' ' A' ' 59' ' ' GLY . 0.7 OUTLIER 166.68 -12.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.636 0.255 . . . . 0.0 111.657 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -157.78 40.27 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.672 0.272 . . . . 0.0 111.128 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 1.043 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -106.69 -169.5 1.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.951 0.405 . . . . 0.0 111.021 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.875 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.59 86.4 0.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.873 ' HB2' HD12 ' B' ' 57' ' ' ILE . 70.6 p -81.19 129.23 34.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.209 0.528 . . . . 0.0 111.779 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.946 ' HB2' ' HB2' ' B' ' 39' ' ' ALA . 15.7 t80 -137.65 70.65 1.39 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.067 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.96 HG12 HD13 ' B' ' 57' ' ' ILE . 3.4 m -100.56 166.62 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.709 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.709 HG22 ' OG1' ' B' ' 53' ' ' THR . 1.4 m -114.32 68.53 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.57 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.581 ' HE2' ' CG ' ' A' ' 12' ' ' ASP . 37.0 p-80 -62.85 -167.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.571 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.485 ' HB2' ' H ' ' A' ' 70' ' ' THR . 0.7 OUTLIER -176.15 -140.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.786 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.485 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 0.3 OUTLIER 36.76 -99.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.265 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.743 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 175.1 27.04 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.893 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.706 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 98.4 m-70 -119.4 49.14 1.39 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.435 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.714 ' HD2' ' HB3' ' A' ' 86' ' ' PHE . 0.3 OUTLIER -128.15 126.44 41.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 -179.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.894 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.4 tt -134.72 137.48 50.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.997 0.427 . . . . 0.0 111.342 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 10' ' ' ASN . 16.8 t80 -124.06 129.67 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.036 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.865 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.5 OUTLIER -159.1 167.7 28.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.01 0.433 . . . . 0.0 111.358 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.645 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 28.2 t80 -131.21 93.29 3.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.546 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.122 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -48.87 175.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.957 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -29.66 -54.27 0.19 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.665 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.529 ' O ' HG23 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -141.41 32.65 1.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.865 0.364 . . . . 0.0 110.961 179.986 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.86 HG11 ' N ' ' A' ' 82' ' ' ALA . 60.1 t -146.49 170.85 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.056 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.86 ' N ' HG11 ' A' ' 81' ' ' VAL . . . -131.48 153.43 49.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.713 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.76 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -144.27 121.57 5.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.925 0.393 . . . . 0.0 111.42 -179.786 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.895 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 3.2 tp -112.41 90.74 3.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.317 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.906 HD11 ' SG ' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -94.76 146.21 24.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.87 -179.32 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.809 ' CE1' HG12 ' B' ' 66' ' ' VAL . 7.8 p90 177.21 140.56 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.936 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.841 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 6.4 mtpm? -99.18 -179.03 4.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.987 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.881 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.265 0.555 . . . . 0.0 110.723 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.448 ' HE ' ' HB3' ' B' ' 4' ' ' ARG . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.771 0.32 . . . . 0.0 111.009 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.476 ' HD2' ' HA ' ' B' ' 5' ' ' LYS . 11.1 mmmt 39.45 28.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.531 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.007 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.44 -167.47 1.77 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.067 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.683 ' O ' ' HE2' ' B' ' 9' ' ' LYS . 75.7 t -152.88 74.33 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.972 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.835 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -42.84 159.78 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.236 0.541 . . . . 0.0 110.861 -179.857 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.683 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 5.7 mmtt -152.15 -14.73 0.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.896 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.579 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.9 OUTLIER -171.4 108.69 0.27 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.778 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.965 ' HB1' HG13 ' B' ' 74' ' ' ILE . . . -141.61 102.77 4.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.876 0.37 . . . . 0.0 111.653 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.785 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 1.7 t70 -85.77 26.28 0.99 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.439 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.875 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 11.0 ttp -114.89 157.53 23.2 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.743 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.749 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -46.24 152.6 0.4 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.619 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.656 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 2.5 mt-10 -56.48 -70.27 0.12 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.127 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.451 ' HA ' ' HG2' ' B' ' 19' ' ' GLN . 0.8 OUTLIER -49.58 -25.67 2.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.989 0.423 . . . . 0.0 110.533 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.751 ' HE1' ' CE2' ' B' ' 50' ' ' TYR . 0.0 OUTLIER -74.3 -41.9 60.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.828 179.796 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.852 ' NE2' ' HB2' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -68.47 -25.37 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.68 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.692 ' HG3' ' N ' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -78.46 -39.98 36.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.016 179.498 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.692 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 0.3 OUTLIER -72.96 -24.4 60.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.053 179.213 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.78 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -74.4 -48.04 30.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.27 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.818 ' HA ' ' CZ ' ' B' ' 76' ' ' PHE . 37.4 t -61.91 -39.76 84.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.463 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 68.7 mt-10 -66.12 -38.81 89.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.067 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.58 ' SG ' ' O ' ' B' ' 20' ' ' ASP . 99.2 m -67.62 -35.25 78.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.712 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.761 ' C ' HD11 ' B' ' 29' ' ' LEU . . . -69.49 -35.8 75.9 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 178.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.743 ' HA ' HD13 ' B' ' 29' ' ' LEU . 88.2 m -65.05 -42.12 94.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.522 178.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.495 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 32.5 mt-30 -54.35 -46.81 73.05 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.585 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.963 ' HB3' HG23 ' B' ' 38' ' ' ILE . . . -74.01 -16.89 61.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.186 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.799 HD12 ' HG ' ' B' ' 78' ' ' LEU . 3.3 mt -80.66 -41.33 23.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.107 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -78.75 -30.22 45.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.799 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.659 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 7.8 mmtp -84.4 -19.46 33.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.623 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.659 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -158.34 149.89 21.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.813 179.679 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.31 27.45 9.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.7 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 1.014 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.3 mm -108.43 106.42 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.928 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.875 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 35.7 mp0 -30.24 -70.71 0.05 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.506 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.33 -60.31 2.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.691 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 1.014 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.1 OUTLIER -44.48 -65.41 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.55 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.963 HG23 ' HB3' ' B' ' 28' ' ' ALA . 10.9 mt -46.64 -45.12 7.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.325 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.946 ' HB2' ' HB2' ' A' ' 65' ' ' TYR . . . -61.99 -43.77 98.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.394 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.738 ' HB3' ' CE1' ' A' ' 65' ' ' TYR . . . -60.82 -64.86 0.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.625 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -42.37 -56.14 3.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.737 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 55.7 mt -46.82 -68.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.647 ' HD3' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -36.45 -57.15 0.77 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.265 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -52.61 -39.74 61.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.462 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.573 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -73.53 -41.88 62.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.196 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.78 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.9 -37.39 87.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.74 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.859 ' HB3' ' HG3' ' B' ' 52' ' ' PRO . 8.0 m-20 -68.32 -46.24 70.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 22.0 mmmt -79.19 -25.11 42.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.573 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.6 tttm -90.16 -12.44 38.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.155 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.751 ' CE2' ' HE1' ' B' ' 17' ' ' MET . 86.0 m-85 -133.39 -71.43 0.51 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.344 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.9 m-20 157.85 107.46 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.069 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.859 ' HG3' ' HB3' ' B' ' 47' ' ' ASP . 72.0 Cg_exo -35.58 156.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.52 2.147 . . . . 0.0 112.691 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.766 HG23 ' CE1' ' B' ' 55' ' ' HIS . 4.7 t -120.94 123.26 42.04 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 123.016 0.527 . . . . 0.0 111.006 -0.02 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.938 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 37.6 m95 -92.79 118.99 31.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.915 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.766 ' CE1' HG23 ' B' ' 53' ' ' THR . 1.9 m-70 -99.54 99.39 10.26 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.739 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 24.4 p -114.96 146.39 41.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.264 0.554 . . . . 0.0 112.471 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.96 HD13 HG12 ' A' ' 66' ' ' VAL . 22.7 mm -128.19 111.51 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.184 178.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.733 HG21 HD12 ' B' ' 83' ' ' ILE . 2.5 p -111.11 135.24 50.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.877 0.37 . . . . 0.0 111.634 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.765 ' O ' HG12 ' B' ' 81' ' ' VAL . . . -165.22 -137.52 2.22 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.967 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.449 ' O ' ' CB ' ' B' ' 61' ' ' ASN . 0.1 OUTLIER -172.33 34.07 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 120.775 0.321 . . . . 0.0 111.269 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.449 ' CB ' ' O ' ' B' ' 60' ' ' ARG . 0.9 OUTLIER 163.81 27.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.776 179.815 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 1.043 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.7 p90 -100.67 165.81 11.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.649 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -121.12 84.29 0.37 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.976 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.727 ' CB ' HD12 ' A' ' 57' ' ' ILE . 3.0 p -79.76 139.27 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.006 0.432 . . . . 0.0 111.444 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.827 ' H ' HD11 ' A' ' 57' ' ' ILE . 4.1 t80 -149.17 64.18 1.03 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.446 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.809 HG12 ' CE1' ' A' ' 86' ' ' PHE . 24.3 m -101.78 140.79 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.487 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 17.4 m -85.33 95.43 9.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.608 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 14.8 p-80 -57.52 -150.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.809 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.608 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER 168.73 116.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.809 HG22 ' HG2' ' B' ' 71' ' ' LYS . 0.5 OUTLIER 81.01 -59.4 0.26 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.476 179.625 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.809 ' HG2' HG22 ' B' ' 70' ' ' THR . 0.0 OUTLIER 174.53 -158.44 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.874 -179.756 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.875 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 29.7 m170 64.1 17.77 10.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.852 ' HA ' ' HA ' ' B' ' 86' ' ' PHE . 4.0 t80 -114.26 77.36 1.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.478 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.965 HG13 ' HB1' ' B' ' 11' ' ' ALA . 1.6 tt -96.0 149.05 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.126 0.489 . . . . 0.0 111.469 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.579 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.3 OUTLIER -140.79 125.5 18.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.619 179.145 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.835 ' HB3' HG13 ' B' ' 8' ' ' ILE . 4.5 p90 -155.3 167.38 30.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.975 0.417 . . . . 0.0 111.24 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.644 ' HH ' ' HA ' ' B' ' 80' ' ' GLN . 10.9 t80 -124.06 111.02 15.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.976 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.007 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -72.65 170.48 14.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.678 179.711 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.498 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.23 -50.0 0.05 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.695 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.703 ' O ' HG22 ' B' ' 81' ' ' VAL . 0.8 OUTLIER -146.05 37.59 1.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.958 0.409 . . . . 0.0 110.692 179.691 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.765 HG12 ' O ' ' B' ' 59' ' ' GLY . 93.3 t -152.08 170.4 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.863 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.647 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -142.66 115.01 8.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 0.0 110.919 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.746 HD11 HG13 ' B' ' 81' ' ' VAL . 0.4 OUTLIER -101.75 129.77 52.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.253 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.819 HD23 ' HB ' ' B' ' 57' ' ' ILE . 0.3 OUTLIER -118.2 87.14 2.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.532 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.714 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -89.46 134.62 34.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.852 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -160.27 126.86 4.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.938 ' HG3' ' HA ' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -110.32 142.95 41.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.024 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.72 ' HB2' ' HE2' ' B' ' 55' ' ' HIS . 0.2 OUTLIER -86.21 19.35 2.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.211 0.529 . . . . 0.0 110.729 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.421 -1.21 . . . . 0.0 112.506 179.901 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.48 ' O ' HD11 ' A' ' 78' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.699 0.285 . . . . 0.0 110.807 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.98 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 160.59 168.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.915 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.669 ' O ' HG11 ' A' ' 7' ' ' VAL . 98.8 t -131.13 60.75 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.929 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.86 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -36.04 132.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.694 -179.897 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -114.33 -16.29 12.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.984 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.622 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 1.7 m-20 -173.99 160.06 3.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.665 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.622 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 171.07 113.86 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.778 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.707 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 41.6 m-20 -98.52 27.62 4.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.024 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.885 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -107.59 168.02 9.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.562 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.885 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -53.69 146.83 12.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.882 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.716 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -56.53 -62.01 2.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.764 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.438 ' H ' ' CD ' ' A' ' 16' ' ' GLU . 2.6 mp0 -53.96 -24.99 18.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.857 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.566 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 60.2 mmm -77.67 -45.86 23.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.99 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.834 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -61.77 -33.16 73.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.72 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -75.53 -40.37 57.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.149 0.499 . . . . 0.0 109.7 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.748 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 1.4 m-20 -69.73 -30.81 68.5 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.548 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.803 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -64.45 -50.31 68.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.824 179.198 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.75 HG13 ' HB2' ' A' ' 6' ' ' ALA . 70.3 t -55.43 -47.4 78.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.009 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -53.73 -39.3 65.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.161 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.496 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -65.43 -41.32 93.64 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.045 179.24 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.769 ' HA ' HD12 ' A' ' 42' ' ' ILE . . . -66.69 -28.94 68.85 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.671 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.6 OUTLIER -72.73 -42.25 64.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.641 178.655 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.518 HE21 ' HB3' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -51.62 -46.06 63.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.528 179.365 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.839 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -81.07 -20.55 41.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.683 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.799 HD11 HD13 ' A' ' 78' ' ' LEU . 6.7 mt -77.46 -29.93 52.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.249 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 -34.77 14.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.204 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.541 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -82.9 -14.14 54.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.449 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.634 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.35 169.7 22.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.761 179.535 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.612 ' C ' HD12 ' A' ' 34' ' ' ILE . 1.3 t30 -137.93 29.18 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.877 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 1.2 mm -116.63 108.22 24.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.065 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.664 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 23.6 mp0 -29.1 -74.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.482 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.4 OUTLIER -42.61 -61.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.753 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.877 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.3 OUTLIER -44.43 -62.85 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.87 ' HB ' HG11 ' A' ' 58' ' ' VAL . 3.3 mt -45.18 -48.46 3.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.899 ' HB1' ' HB2' ' B' ' 65' ' ' TYR . . . -57.94 -43.85 86.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.071 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.788 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -55.94 -64.77 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.067 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.699 ' HD1' ' HB1' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -49.15 -56.8 8.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.931 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.769 HD12 ' HA ' ' A' ' 25' ' ' ALA . 47.3 mt -42.52 -62.52 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.857 ' HE2' ' H ' ' A' ' 54' ' ' TRP . 13.0 tptp -51.49 -60.44 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.01 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -36.93 -56.02 0.89 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.069 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 48' ' ' LYS . 18.3 tt0 -60.97 -69.06 0.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.803 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.3 OUTLIER -37.35 -38.16 0.22 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.315 -179.84 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.726 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.1 OUTLIER -71.58 -38.52 70.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.471 -179.467 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.478 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -101.64 9.96 40.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.723 0.297 . . . . 0.0 111.373 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.468 ' HZ2' ' HB3' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -125.54 -7.48 6.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.323 -179.899 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.748 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 39.8 m-85 -133.04 -63.3 0.77 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.994 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.487 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.1 OUTLIER 161.79 108.86 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.313 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.726 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 73.0 Cg_exo -49.53 153.56 5.11 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.446 2.097 . . . . 0.0 112.434 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.963 HG23 HG22 ' B' ' 67' ' ' THR . 44.5 m -117.06 137.11 52.48 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 122.998 0.519 . . . . 0.0 110.699 0.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.857 ' H ' ' HE2' ' A' ' 43' ' ' LYS . 64.8 m95 -98.76 160.81 14.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.39 0.614 . . . . 0.0 111.748 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.853 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 2.4 m-70 -141.26 100.42 3.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.016 179.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.769 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 0.8 OUTLIER -113.27 144.35 42.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.355 0.597 . . . . 0.0 112.573 -178.051 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.97 HG12 HD22 ' A' ' 84' ' ' LEU . 18.0 mm -132.87 111.82 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.334 179.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.87 HG11 ' HB ' ' A' ' 38' ' ' ILE . 2.8 p -111.01 126.83 68.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.933 0.397 . . . . 0.0 111.58 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.585 ' HA3' ' CB ' ' B' ' 62' ' ' PHE . . . -147.48 -151.34 5.4 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.685 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.5 26.02 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.773 0.287 . . . . 0.0 111.586 -179.75 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.685 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 164.5 26.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 0.0 111.143 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.879 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 14.8 p90 -102.67 -179.54 4.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.842 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.775 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -132.6 108.57 0.78 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.785 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.879 ' HB3' ' HE1' ' A' ' 62' ' ' PHE . 7.2 p -93.94 124.75 38.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.982 0.42 . . . . 0.0 111.53 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.809 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 33.1 t80 -135.8 82.14 1.93 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.376 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 1.013 HG11 HD12 ' B' ' 57' ' ' ILE . 14.6 m -125.89 152.27 32.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.4 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.816 HG23 HG21 ' B' ' 53' ' ' THR . 0.6 OUTLIER -79.49 115.71 19.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.617 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.819 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -74.87 148.41 40.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.96 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.733 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 3.5 mm-40 -113.94 -131.52 0.32 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.481 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.59 ' C ' ' H ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -27.57 -99.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.679 -179.56 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.745 ' O ' ' HB2' ' A' ' 13' ' ' MET . 0.1 OUTLIER -70.29 22.49 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.962 0.41 . . . . 0.0 110.697 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.819 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 24.6 m-70 56.97 -85.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.874 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.732 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 164.61 -170.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.895 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.834 HG13 ' HB3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -160.34 110.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.597 179.771 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.594 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 34.6 t80 -103.71 137.26 42.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.605 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.86 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.5 OUTLIER -151.17 169.73 21.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.81 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.774 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 10.2 t80 -126.59 98.11 5.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.002 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.98 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.3 OUTLIER -59.46 177.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.73 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.532 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -56.63 81.4 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.464 179.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.774 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.0 OUTLIER 84.1 22.87 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.177 0.513 . . . . 0.0 110.016 -178.9 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.884 ' HB ' ' HB2' ' A' ' 78' ' ' LEU . 72.5 t -142.63 173.02 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.75 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.877 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -146.25 146.26 30.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.695 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.727 HG22 ' HB2' ' A' ' 25' ' ' ALA . 0.7 OUTLIER -135.79 133.1 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.008 0.432 . . . . 0.0 111.531 -179.517 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.97 HD22 HG12 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -118.34 93.96 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.045 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.732 ' O ' ' HB2' ' A' ' 73' ' ' PHE . 0.7 OUTLIER -98.81 124.67 43.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.636 -179.155 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.636 ' HZ ' ' CE2' ' B' ' 86' ' ' PHE . 18.7 p90 -162.72 129.95 3.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.049 179.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.852 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 1.0 OUTLIER -104.87 151.17 24.16 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.926 0.393 . . . . 0.0 111.159 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.733 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-O 121.329 0.585 . . . . 0.0 110.741 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . 27.0 mmt-85 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.724 0.297 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.547 ' HE2' HG22 ' B' ' 26' ' ' THR . 0.0 OUTLIER 72.51 174.36 0.29 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.828 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.024 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 66.06 164.64 0.18 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.422 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.654 HG12 ' HE3' ' B' ' 9' ' ' LYS . 24.3 t -130.43 71.9 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.739 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.813 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -32.08 152.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.77 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.808 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 1.8 mmpt? -147.16 -6.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.511 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.598 ' HB3' ' HZ ' ' B' ' 73' ' ' PHE . 0.3 OUTLIER -176.65 90.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.516 179.905 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.984 ' HB2' HG13 ' B' ' 74' ' ' ILE . . . -127.98 97.74 4.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.423 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.794 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 1.4 m-20 -95.07 25.96 3.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.067 0.46 . . . . 0.0 110.393 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.716 ' HG3' ' H ' ' B' ' 14' ' ' SER . 12.8 ttp -110.4 168.78 9.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.544 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.716 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.6 OUTLIER -49.24 125.83 11.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.766 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.479 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 45.9 mt-10 -39.29 -56.37 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.785 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -56.41 -30.6 62.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.779 ' HE3' ' CE2' ' B' ' 50' ' ' TYR . 30.8 mmm -72.82 -44.09 61.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.071 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.854 ' HA ' HD13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -62.94 -32.39 73.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -75.03 -42.77 56.56 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.196 0.522 . . . . 0.0 109.682 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.528 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 25.1 m-20 -68.1 -28.87 67.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.511 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.775 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -66.67 -48.62 68.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.956 179.094 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.807 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 90.9 t -55.27 -50.15 66.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.136 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.83 -34.99 68.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.948 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.47 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 3.2 m -69.55 -36.12 76.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.754 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.94 ' HB2' HG23 ' B' ' 83' ' ' ILE . . . -71.36 -28.81 64.32 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.547 HG22 ' HE2' ' B' ' 5' ' ' LYS . 3.7 m -74.31 -40.39 62.27 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.75 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.753 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 1.8 mm-40 -56.6 -44.43 81.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.681 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.928 ' HB3' HG22 ' B' ' 38' ' ' ILE . . . -68.21 -36.7 79.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.067 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.79 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.8 mt -65.46 -41.08 93.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -25.88 54.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.736 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.753 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 23.6 mmtm -88.12 -22.65 23.99 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.687 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.529 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -159.66 163.71 34.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.699 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.469 ' OD1' ' N ' ' B' ' 33' ' ' ASN . 0.0 OUTLIER -123.28 29.75 6.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.935 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.709 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.7 mm -113.67 106.41 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.892 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.775 ' HB3' ' HA3' ' A' ' 63' ' ' GLY . 1.2 mp0 -29.89 -70.34 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.898 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.568 ' HG3' HG23 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -43.33 -52.33 5.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.633 179.559 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.709 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 7.0 t0 -55.49 -60.49 3.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.369 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.928 HG22 ' HB3' ' B' ' 28' ' ' ALA . 3.8 mt -42.74 -55.1 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.713 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.963 ' HB3' HG13 ' B' ' 58' ' ' VAL . . . -49.46 -53.73 21.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.809 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -51.37 -69.29 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.263 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.721 ' CD2' ' HB1' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -33.78 -42.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.359 179.134 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 1.03 HG23 HD12 ' B' ' 85' ' ' LEU . 53.6 mt -69.04 -66.35 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.324 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.672 ' HZ2' ' HB ' ' A' ' 67' ' ' THR . 7.3 tttp -40.49 -43.55 1.86 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.075 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -69.02 -49.4 58.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.277 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 41.6 tt0 -63.22 -25.95 68.57 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.775 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -79.33 -37.81 36.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.874 0.369 . . . . 0.0 110.771 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.945 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.62 -32.82 73.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.609 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.4 mmmt -90.56 -33.78 15.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.221 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.544 ' HD3' ' CE1' ' B' ' 50' ' ' TYR . 7.7 tttp -81.03 -12.66 59.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.387 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.779 ' CE2' ' HE3' ' B' ' 17' ' ' MET . 17.4 m-85 -142.75 -66.59 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.658 0.266 . . . . 0.0 111.596 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.748 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.2 t30 160.74 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.398 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.945 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 21.0 Cg_endo -60.43 169.42 5.29 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.472 2.115 . . . . 0.0 112.377 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.816 HG21 HG23 ' A' ' 67' ' ' THR . 1.8 t -110.89 120.73 43.37 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 122.926 0.49 . . . . 0.0 110.733 0.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.83 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 31.2 m95 -90.55 141.23 28.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.46 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.821 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 4.1 m170 -107.1 105.39 15.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.338 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.612 ' HB2' ' CD1' ' B' ' 85' ' ' LEU . 9.8 t -111.74 133.08 54.21 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 1.013 HD12 HG11 ' A' ' 66' ' ' VAL . 23.8 mm -127.08 99.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.56 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.963 HG13 ' HB3' ' B' ' 39' ' ' ALA . 2.6 p -104.98 118.78 52.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.048 0.451 . . . . 0.0 111.847 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.783 ' O ' HG12 ' B' ' 81' ' ' VAL . . . -134.87 -116.03 1.59 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.198 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -174.15 -31.86 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.786 0.327 . . . . 0.0 111.022 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.419 HD21 ' HA ' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -154.67 43.11 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.925 -179.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.923 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 27.9 p90 -99.68 -167.15 1.42 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 0.0 111.07 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.664 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -140.5 98.11 0.23 Allowed Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.709 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.936 ' HA ' HD13 ' A' ' 57' ' ' ILE . 3.8 p -89.22 128.42 35.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.996 0.427 . . . . 0.0 111.668 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.899 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 52.5 t80 -139.48 86.54 2.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.343 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.853 ' HB ' ' HB3' ' A' ' 55' ' ' HIS . 12.2 m -136.92 141.42 40.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.179 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.963 HG22 HG23 ' A' ' 53' ' ' THR . 1.3 t -70.37 139.54 51.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.043 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.759 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -98.76 162.15 13.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.495 ' O ' ' O ' ' B' ' 70' ' ' THR . 0.1 OUTLIER -131.75 -101.26 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.33 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.566 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -46.04 -108.08 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.389 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.687 ' O ' ' HB2' ' B' ' 13' ' ' MET . 2.1 mmtp -70.5 29.3 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.88 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.794 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 37.9 m-70 57.22 -83.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.773 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 163.05 -153.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.73 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.984 HG13 ' HB2' ' B' ' 11' ' ' ALA . 0.6 OUTLIER -172.54 135.6 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.549 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.808 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 5.2 t80 -124.05 139.62 53.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.999 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.813 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.8 OUTLIER -165.73 147.11 7.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.977 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.862 ' HH ' ' HA ' ' B' ' 80' ' ' GLN . 64.5 t80 -112.7 109.5 19.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.024 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.4 mm? -69.1 169.55 11.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.061 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.543 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -19.75 -67.86 0.01 OUTLIER Glycine 0 C--N 1.335 0.479 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.86 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.862 ' HA ' ' HH ' ' B' ' 77' ' ' TYR . 0.0 OUTLIER -130.86 39.0 3.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.049 0.452 . . . . 0.0 110.064 179.223 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.892 HG12 ' H ' ' B' ' 82' ' ' ALA . 93.0 t -152.69 170.18 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.114 -179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.892 ' H ' HG12 ' B' ' 81' ' ' VAL . . . -131.51 162.15 30.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.367 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.94 HG23 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -145.61 133.98 16.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.977 0.417 . . . . 0.0 111.489 -179.615 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.848 ' HB3' ' HB ' ' B' ' 57' ' ' ILE . 4.9 tp -124.15 88.19 2.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.444 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 1.03 HD12 HG23 ' B' ' 42' ' ' ILE . 0.8 OUTLIER -95.02 122.33 37.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.246 -179.44 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.636 ' CE2' ' HZ ' ' A' ' 86' ' ' PHE . 0.5 OUTLIER -153.52 120.1 5.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.022 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.83 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -86.22 132.06 34.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.893 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.821 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 2.4 m -94.73 19.53 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.228 0.537 . . . . 0.0 110.956 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . 0.471 ' OXT' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.368 -1.24 . . . . 0.0 112.525 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.758 0.313 . . . . 0.0 111.295 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.118 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -131.07 -171.05 2.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.128 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 6' ' ' ALA . 25.9 t -145.79 78.69 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.262 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.772 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 1.4 mp -40.03 142.41 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 3.7 mmpt? -129.83 -12.78 4.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.03 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.483 ' HB3' ' H ' ' A' ' 11' ' ' ALA . 14.4 t30 -154.89 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 1.075 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 76.68 -176.59 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.619 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.769 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 1.0 OUTLIER 162.23 22.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.807 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.909 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 11.0 ttp -114.58 164.59 13.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.687 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 1.048 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 68.5 m -45.3 135.27 6.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.522 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.443 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.2 mm-40 -41.67 -75.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.071 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -44.68 -22.15 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 1.048 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.54 -39.73 31.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.667 ' HG2' ' O ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -67.73 -30.1 69.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.589 179.811 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -45.77 19.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -68.18 -29.49 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.484 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.804 ' OG ' HG22 ' A' ' 74' ' ' ILE . 0.2 OUTLIER -66.66 -50.83 61.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.086 179.182 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.802 ' HA ' ' CZ ' ' A' ' 76' ' ' PHE . 58.0 t -57.13 -40.36 72.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.343 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.85 -34.66 78.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.203 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.46 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -71.78 -34.06 69.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.764 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.669 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -73.42 -34.15 65.33 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 1.038 ' HA ' HD12 ' A' ' 29' ' ' LEU . 42.0 m -71.71 -40.19 69.64 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.619 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.828 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -56.17 -43.33 78.28 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.249 178.94 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.877 ' HB2' HG23 ' A' ' 38' ' ' ILE . . . -74.93 -22.92 58.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.807 178.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 1.038 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.9 mt -73.46 -38.38 65.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.945 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.01 -25.21 26.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.746 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -83.92 -35.27 24.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.725 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.651 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -149.92 150.58 32.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.627 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -127.51 48.57 2.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.772 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.85 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 40.4 mm -115.45 43.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.672 ' HG2' ' HA ' ' B' ' 62' ' ' PHE . 3.1 mp0 34.56 -87.56 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.596 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.613 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -43.19 -53.75 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.865 0.364 . . . . 0.0 110.456 179.53 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.85 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.4 t70 -45.86 -61.94 1.52 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.588 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.877 HG23 ' HB2' ' A' ' 28' ' ' ALA . 3.7 mt -45.5 -58.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.814 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -49.29 -54.61 16.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.722 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -42.53 -55.24 3.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.111 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.552 ' HD1' ' HB1' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.817 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.7 HG22 HD13 ' A' ' 85' ' ' LEU . 64.2 mt -47.68 -69.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.218 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.855 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -49.97 -67.08 0.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.987 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.768 ' HD2' ' N ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -33.0 -59.69 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.911 -179.974 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.768 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 5.2 tp10 -54.66 -54.84 36.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.695 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -52.66 -31.65 38.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.942 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.741 ' OD1' ' HB2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -72.94 -32.15 65.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.872 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mmmm -106.27 4.61 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.372 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.484 ' O ' ' CG ' ' A' ' 50' ' ' TYR . 6.2 tttp -123.98 13.75 9.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.789 0.328 . . . . 0.0 111.101 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.664 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 57.2 m-85 -159.94 -66.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.12 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.488 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 0.6 OUTLIER 162.09 115.57 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.726 -179.773 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.726 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 36.4 Cg_endo -64.98 170.49 10.25 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.433 2.089 . . . . 0.0 112.398 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.723 ' HG1' HG21 ' B' ' 67' ' ' THR . 1.5 t -102.65 128.12 49.47 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 122.86 0.464 . . . . 0.0 110.358 -0.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.81 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 63.6 m95 -94.27 151.44 19.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.407 0.622 . . . . 0.0 111.929 -179.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.808 ' HB2' ' CE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -136.67 94.19 2.96 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.954 179.257 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.748 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 8.8 p -115.97 154.9 29.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.349 0.595 . . . . 0.0 112.422 -178.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.956 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 16.3 mm -126.96 174.71 10.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.001 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.71 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 8.1 p -170.88 110.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.961 0.41 . . . . 0.0 111.76 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.737 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -154.39 -135.83 2.15 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.765 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.5 ptt180 -173.69 -9.85 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.533 HD21 ' N ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -148.72 44.83 1.02 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.087 -179.896 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.875 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -120.19 165.73 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.93 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.853 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -112.77 86.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.792 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.98 ' HA ' HD12 ' B' ' 57' ' ' ILE . 2.9 p -81.91 118.56 23.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.045 0.45 . . . . 0.0 111.58 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.871 ' HB2' ' HB2' ' B' ' 39' ' ' ALA . 7.4 t80 -132.37 76.68 1.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.945 HG11 HD11 ' B' ' 57' ' ' ILE . 5.5 m -127.55 140.44 49.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.719 HG22 ' NE2' ' B' ' 55' ' ' HIS . 3.3 t -95.69 120.52 36.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.43 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -60.95 -164.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.876 -179.89 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.508 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 1.0 OUTLIER -127.11 -46.84 1.5 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.346 -179.752 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.5 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 28.3 m -157.92 -42.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.481 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.769 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 7.7 mtpt -164.7 -159.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.758 0.313 . . . . 0.0 110.882 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 1.05 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 0.0 OUTLIER 56.17 18.82 3.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.011 0.434 . . . . 0.0 110.436 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.836 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 7.0 t80 -116.15 101.61 8.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.498 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 1.075 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -121.4 118.25 55.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.316 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -115.21 94.6 4.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.763 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.802 ' CZ ' ' HA ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -114.7 -178.88 3.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.164 -179.778 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.68 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 16.1 t80 -140.31 102.69 4.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.118 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -59.64 173.05 0.6 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.273 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.96 -44.86 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.936 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.418 ' N ' ' O ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -148.21 26.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.22 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.737 HG12 ' O ' ' A' ' 59' ' ' GLY . 72.2 t -139.65 168.3 18.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.989 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.736 ' H ' HG12 ' A' ' 81' ' ' VAL . . . -136.63 125.88 24.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.744 HG22 ' O ' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -113.23 119.99 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.993 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.956 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 21.4 tp -100.78 80.45 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.18 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.714 ' CB ' HG21 ' A' ' 74' ' ' ILE . 0.2 OUTLIER -86.32 137.78 32.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.072 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.836 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -174.23 127.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.563 179.635 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 1.05 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -90.14 -169.75 2.53 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.925 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.654 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-O 121.308 0.575 . . . . 0.0 110.81 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.486 ' NH1' HE22 ' B' ' 19' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.457 -0.093 0 CA-C-O 120.868 0.366 . . . . 0.0 110.684 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.622 ' HG2' ' H ' ' B' ' 6' ' ' ALA . 22.8 tttt 76.62 -152.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.724 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.073 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 52.74 175.85 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.183 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.741 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 59.0 t -147.83 71.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.727 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.802 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -34.8 140.32 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.521 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.741 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 3.2 mmtp -115.27 -25.58 7.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.213 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.406 ' HB2' ' H ' ' B' ' 11' ' ' ALA . 31.2 m-20 -140.83 -87.97 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.165 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 1.068 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 62.64 106.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.095 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -109.28 24.32 13.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.648 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.763 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -107.82 173.31 6.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.763 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.2 OUTLIER -54.61 128.0 30.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.856 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.58 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 1.7 mm-40 -39.85 -64.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -50.36 -27.45 6.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.548 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.645 ' HB2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -75.55 -31.61 60.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.701 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.745 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -71.29 -36.2 71.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.395 179.65 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 20.1 mt-30 -74.82 -35.57 62.44 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.88 -34.91 62.29 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.841 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 1.4 t -65.19 -42.49 93.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.756 179.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.916 HG12 ' HB2' ' B' ' 6' ' ' ALA . 91.2 t -60.94 -50.0 82.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.332 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 20.7 mt-10 -53.75 -38.61 64.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.297 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.607 ' SG ' ' CE1' ' B' ' 46' ' ' PHE . 71.9 m -65.71 -38.46 89.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.011 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.898 ' HA ' HD12 ' B' ' 42' ' ' ILE . . . -68.77 -30.2 68.75 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.603 ' HA ' HD12 ' B' ' 29' ' ' LEU . 0.7 OUTLIER -72.43 -40.2 67.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.361 -1.291 . . . . 0.0 109.926 178.787 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.838 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -56.86 -43.77 81.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.892 179.354 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.933 ' HB1' ' HB3' ' B' ' 41' ' ' HIS . . . -73.51 -34.29 65.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.423 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.645 HD11 ' HG ' ' B' ' 78' ' ' LEU . 2.3 mt -65.53 -40.82 93.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.876 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.96 -18.52 34.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 1.1 mmmm -83.38 -21.14 33.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.568 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.1 OUTLIER -153.01 -49.0 0.1 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.792 -179.921 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.471 ' CB ' ' O ' ' B' ' 32' ' ' TYR . 3.4 t-20 83.37 28.42 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.777 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.875 HD12 ' N ' ' B' ' 34' ' ' ILE . 1.1 mp -111.2 140.76 29.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.736 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.853 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -53.91 -70.91 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.897 0.379 . . . . 0.0 110.62 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.425 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -54.18 -55.86 23.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.599 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 12.3 t0 -47.4 -60.74 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.723 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.734 ' CG2' ' HB2' ' B' ' 28' ' ' ALA . 26.6 mt -46.88 -60.66 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.982 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.871 ' HB2' ' HB2' ' A' ' 65' ' ' TYR . . . -40.94 -46.1 2.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 0.0 110.562 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.807 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -63.08 -62.93 1.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.406 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.933 ' HB3' ' HB1' ' B' ' 28' ' ' ALA . 0.8 OUTLIER -39.23 -42.3 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.59 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.898 HD12 ' HA ' ' B' ' 25' ' ' ALA . 7.9 mt -72.47 -70.14 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.256 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.78 ' HD3' ' HD2' ' A' ' 65' ' ' TYR . 27.9 tttp -36.97 -48.02 0.74 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.627 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 6.5 mttt -62.39 -56.03 22.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.261 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.761 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -57.01 -58.32 8.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.831 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.841 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -40.57 -64.24 0.55 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.958 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.784 ' HB2' ' HG3' ' B' ' 52' ' ' PRO . 2.8 p30 -46.4 -42.41 15.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.844 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.761 ' HG3' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -69.93 -36.87 75.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.865 -179.379 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.484 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.35 -9.66 46.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.693 -179.212 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.753 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 92.8 m-85 -127.5 -70.05 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.454 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.753 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 5.7 t-20 161.06 109.45 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.035 -179.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.784 ' HG3' ' HB2' ' B' ' 47' ' ' ASP . 96.8 Cg_exo -43.53 154.65 0.2 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 122.344 2.029 . . . . 0.0 112.479 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.632 HG21 ' HZ3' ' B' ' 43' ' ' LYS . 6.1 m -119.2 134.62 55.11 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 122.927 0.491 . . . . 0.0 110.652 0.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.763 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 45.0 m95 -100.12 125.71 46.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.055 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.909 ' HB3' HG12 ' A' ' 66' ' ' VAL . 62.8 m170 -93.77 94.76 8.72 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.814 ' HB2' HD13 ' B' ' 85' ' ' LEU . 0.7 OUTLIER -102.52 151.39 22.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -177.37 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.98 HD12 ' HA ' ' A' ' 64' ' ' SER . 13.7 mm -139.83 155.82 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.386 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.757 HG21 ' CD1' ' B' ' 83' ' ' ILE . 1.5 p -162.11 109.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 111.59 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.77 ' HA3' ' HA ' ' A' ' 62' ' ' PHE . . . -136.23 -123.28 2.26 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.832 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' B' ' 60' ' ' ARG . 0.8 OUTLIER -166.09 -23.88 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.57 0.224 . . . . 0.0 111.523 179.907 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.612 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 1.5 m-20 -157.61 46.25 0.37 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.824 0.345 . . . . 0.0 111.282 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.875 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.2 p90 -102.88 175.08 5.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.938 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.79 87.43 0.41 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.375 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.79 ' HB2' HD21 ' B' ' 84' ' ' LEU . 10.9 p -85.21 121.64 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.958 0.409 . . . . 0.0 111.105 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.882 ' H ' HD13 ' A' ' 57' ' ' ILE . 11.6 t80 -134.18 61.33 1.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.629 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.799 HG12 ' HE2' ' A' ' 86' ' ' PHE . 17.5 m -96.7 164.65 2.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.16 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.723 HG21 ' HG1' ' A' ' 53' ' ' THR . 93.5 m -101.7 98.93 9.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.841 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -43.36 169.85 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.714 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.8 OUTLIER -142.13 -119.78 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.99 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.577 ' C ' ' H ' ' B' ' 72' ' ' HIS . 41.5 p -39.4 -98.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.014 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.514 ' O ' ' HB2' ' B' ' 13' ' ' MET . 3.4 mmmm -68.74 18.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.77 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.841 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 20.1 m170 65.78 -88.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.757 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 2.4 p90 165.74 -176.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.0 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 1.068 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -156.67 114.63 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.545 179.305 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.801 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 1.3 t80 -100.4 137.71 38.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.918 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.802 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 1.0 OUTLIER -162.62 156.83 21.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.824 0.345 . . . . 0.0 111.376 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.598 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 2.1 t80 -116.89 112.61 21.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.292 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.073 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.1 mm? -69.92 170.31 11.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.639 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.5 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -28.5 -36.29 0.01 OUTLIER Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.497 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.577 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.4 OUTLIER -158.62 44.35 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.921 0.391 . . . . 0.0 110.694 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.902 HG13 ' H ' ' B' ' 82' ' ' ALA . 37.7 t -160.02 169.36 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.036 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.902 ' H ' HG13 ' B' ' 81' ' ' VAL . . . -135.88 111.13 9.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.344 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.761 ' HB ' ' CZ ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -98.64 133.61 40.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.157 0.503 . . . . 0.0 112.012 -179.191 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.801 ' HB2' ' CE1' ' B' ' 75' ' ' TYR . 0.4 OUTLIER -118.85 94.39 4.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.768 179.423 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.814 HD13 ' HB2' ' B' ' 56' ' ' CYS . 0.5 OUTLIER -98.24 135.7 39.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -179.031 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.729 ' O ' ' HB2' ' B' ' 55' ' ' HIS . 9.3 p90 -174.43 121.03 0.26 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.84 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.763 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -90.49 161.51 15.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 110.923 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.714 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -117.76 21.23 13.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.338 0.59 . . . . 0.0 110.486 179.774 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.151 0 CA-C-O 118.325 -1.264 . . . . 0.0 112.504 -179.806 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.8 0.333 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.959 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.41 153.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.521 ' O ' ' HG2' ' A' ' 9' ' ' LYS . 92.4 t -118.66 71.12 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.834 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.873 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -35.63 137.02 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 7' ' ' VAL . 12.0 mmtt -125.82 -11.26 6.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.647 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.559 ' O ' ' HE1' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -168.52 87.12 0.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.799 -179.833 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.749 ' HB3' HG12 ' A' ' 74' ' ' ILE . . . -121.91 109.42 14.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.911 0.386 . . . . 0.0 111.685 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.618 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 2.7 m-20 -112.23 30.66 6.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.123 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.691 ' HG3' ' H ' ' A' ' 14' ' ' SER . 11.3 ttp -117.89 171.05 8.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.761 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.714 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 m -53.55 134.62 40.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.028 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.627 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 tm-20 -45.99 -68.27 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.93 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.708 ' HA ' ' NE2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -44.49 -27.33 0.44 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.831 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.693 ' HE2' ' CE2' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -75.79 -50.03 16.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.541 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.983 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -58.72 -26.83 64.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.481 179.738 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.708 ' NE2' ' HA ' ' A' ' 16' ' ' GLU . 4.2 pt20 -77.85 -45.29 24.74 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.423 ' OD2' ' O ' ' A' ' 16' ' ' GLU . 36.5 m-20 -67.4 -26.53 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.563 178.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.777 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 28.8 t -68.0 -52.57 34.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.612 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.816 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 47.5 t -54.5 -47.7 70.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.48 -35.81 72.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.95 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.729 ' SG ' HG23 ' A' ' 42' ' ' ILE . 10.2 t -67.29 -35.4 79.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.986 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.802 ' HB2' HG23 ' A' ' 83' ' ' ILE . . . -72.86 -33.99 66.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.612 ' HA ' HD12 ' A' ' 29' ' ' LEU . 2.4 m -69.62 -37.32 76.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.498 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 2.7 mt-30 -61.78 -41.73 98.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.855 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.735 ' HB3' ' CG2' ' A' ' 38' ' ' ILE . . . -79.5 -17.4 54.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.138 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.651 HD12 ' C ' ' A' ' 25' ' ' ALA . 5.5 mt -80.97 -37.01 30.05 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.971 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.21 -26.96 23.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.249 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.498 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -85.07 -23.6 28.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.951 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.602 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -144.29 -161.2 1.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -166.32 28.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.613 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 1.034 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.4 mm -118.39 103.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.665 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.652 ' HA ' HD11 ' A' ' 38' ' ' ILE . 1.0 OUTLIER -26.33 -77.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.012 0.434 . . . . 0.0 110.821 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.509 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -40.36 -42.15 1.51 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.905 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 1.034 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -64.89 -58.75 5.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.735 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 3.8 mt -46.82 -48.42 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.765 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.56 -38.86 82.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.867 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.791 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -59.85 -67.71 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.015 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.643 ' HD1' ' HB2' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -50.39 -49.96 52.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.824 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.731 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 98.2 mt -49.99 -67.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.167 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.791 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 4.5 tmtt? -51.25 -40.75 59.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.58 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 1.1 tppt? -54.39 -57.37 11.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.015 0.436 . . . . 0.0 110.736 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 49' ' ' LYS . 5.3 mt-10 -54.0 -54.57 37.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.644 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.777 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.7 m-85 -52.23 -46.75 65.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.867 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.791 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.81 -12.54 61.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.292 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.66 13.21 9.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.739 0.304 . . . . 0.0 111.259 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' A' ' 45' ' ' GLU . 6.0 ttmm -129.96 -31.61 1.92 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.189 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.672 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 60.0 m-85 -109.82 -57.23 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.074 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.763 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 0.0 OUTLIER 160.83 114.22 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.433 -179.789 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.728 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 16.5 Cg_endo -57.16 165.92 4.82 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.355 2.037 . . . . 0.0 112.455 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.492 HG22 ' CE1' ' A' ' 55' ' ' HIS . 1.2 m -108.66 124.89 51.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 122.974 0.509 . . . . 0.0 110.361 -0.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.765 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.5 m95 -96.89 160.84 14.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.607 . . . . 0.0 111.996 -179.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.817 ' HD2' ' HA ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -152.43 111.98 3.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.079 179.352 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.812 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 13.7 p -120.3 151.61 38.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.91 HD12 ' HA ' ' B' ' 64' ' ' SER . 20.8 mm -126.03 118.36 51.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.444 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.765 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.4 p -113.04 124.03 69.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.511 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -157.9 173.84 35.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.275 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.485 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.5 OUTLIER -137.7 40.05 2.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.678 0.275 . . . . 0.0 111.295 -179.632 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.485 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER 167.89 28.8 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.919 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.882 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 15.7 p90 -117.0 -172.32 2.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.163 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.794 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.63 102.49 0.27 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.737 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.954 ' HA ' HD13 ' B' ' 57' ' ' ILE . 63.6 p -84.87 138.22 32.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.063 0.459 . . . . 0.0 111.731 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.925 ' HB3' ' HB3' ' B' ' 39' ' ' ALA . 54.8 t80 -153.32 89.63 1.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.034 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.9 HG12 HD12 ' B' ' 57' ' ' ILE . 6.2 m -135.18 -161.44 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.203 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.739 HG22 ' N ' ' A' ' 68' ' ' HIS . 0.7 OUTLIER -99.88 -161.16 0.85 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.794 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.739 ' N ' HG22 ' A' ' 67' ' ' THR . 38.4 p-80 -168.42 122.53 0.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.804 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.515 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -130.83 157.89 41.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.403 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 74.94 -85.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.047 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 13' ' ' MET . 28.7 mttt -109.96 14.44 23.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.696 ' O ' ' HB2' ' A' ' 68' ' ' HIS . 6.7 m170 71.64 -86.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.752 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.665 ' HB3' ' CB ' ' A' ' 86' ' ' PHE . 1.8 p90 162.3 -167.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.436 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.983 HG13 ' HB3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -165.39 110.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.994 0.426 . . . . 0.0 111.673 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.737 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -100.39 138.06 37.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.079 179.198 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.884 ' HE1' HG22 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -159.22 132.97 7.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.979 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.599 ' HA ' ' O ' ' A' ' 81' ' ' VAL . 18.7 t80 -98.95 102.37 14.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.798 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.959 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.2 mm? -55.82 170.02 0.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.763 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.89 -33.25 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.661 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.699 ' O ' HG21 ' A' ' 81' ' ' VAL . 0.4 OUTLIER -160.08 39.84 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 111.094 -179.812 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.873 HG12 ' N ' ' A' ' 82' ' ' ALA . 81.3 t -156.95 165.31 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.746 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.873 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -125.82 140.97 52.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.553 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.802 HG23 ' HB2' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -134.18 130.73 54.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.979 0.418 . . . . 0.0 111.446 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.812 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -120.35 97.7 5.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.851 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.741 HD23 ' OG ' ' A' ' 21' ' ' SER . 1.4 mp -99.65 124.34 44.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.61 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.665 ' CB ' ' HB3' ' A' ' 73' ' ' PHE . 3.0 p90 -166.04 140.79 4.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.29 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.817 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 15.8 mtpt -90.24 -147.18 0.19 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.593 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.673 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.386 0.612 . . . . 0.0 110.473 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.576 ' O ' ' HB3' ' B' ' 5' ' ' LYS . 1.9 tpp85 . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.81 0.338 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.58 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.7 OUTLIER 79.32 31.04 0.29 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.667 -179.757 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.066 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.46 -165.94 1.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.454 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.75 HG22 ' O ' ' B' ' 6' ' ' ALA . 87.7 t -154.08 75.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.195 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.744 ' HA ' ' CB ' ' B' ' 76' ' ' PHE . 1.3 mp -34.69 140.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.266 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.441 ' HE3' ' HB3' ' B' ' 77' ' ' TYR . 7.0 mmtp -119.55 -11.32 9.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.769 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.603 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 1.2 t-20 -168.7 -94.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.392 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.892 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 80.41 -179.67 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.598 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.4 m-20 177.15 35.26 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.694 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.743 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 19.6 ttp -130.87 167.66 18.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.838 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.587 ' O ' ' HB2' ' B' ' 17' ' ' MET . 0.0 OUTLIER -48.63 131.3 17.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.91 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' B' ' 18' ' ' GLN . 1.7 mp0 -40.99 -64.92 0.48 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.671 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 1.1 mm-40 -46.32 -35.96 5.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.305 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.743 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 43.9 mmm -68.34 -33.72 74.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.049 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.884 ' HB3' HD11 ' B' ' 74' ' ' ILE . 0.7 OUTLIER -73.54 -33.74 64.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.137 179.232 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.718 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 13.1 pt20 -78.0 -36.36 48.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.582 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.662 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER -76.53 -31.64 57.76 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.323 178.623 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.801 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -67.88 -49.13 63.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.861 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.795 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 48.6 t -59.47 -42.94 89.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.228 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.718 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 2.2 mt-10 -60.71 -34.33 74.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.079 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 47.1 m -68.85 -38.5 79.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.118 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.677 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -68.98 -28.23 66.43 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.856 ' HA ' HD12 ' B' ' 29' ' ' LEU . 4.2 m -72.05 -37.74 69.63 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.64 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.726 ' O ' ' HD3' ' B' ' 31' ' ' LYS . 44.2 mt-30 -59.14 -45.71 90.24 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.454 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.924 ' HB3' ' HA ' ' B' ' 38' ' ' ILE . . . -75.81 -20.37 58.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.486 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.856 HD12 ' HA ' ' B' ' 26' ' ' THR . 4.8 mt -76.42 -45.1 33.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.054 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.29 -23.74 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.992 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.726 ' HD3' ' O ' ' B' ' 27' ' ' GLN . 1.3 mttp -84.93 -33.52 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.731 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.631 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -141.03 -175.94 4.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.63 179.857 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -145.97 34.82 1.01 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.892 0.377 . . . . 0.0 110.842 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.996 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.5 mm -120.23 103.82 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.084 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.794 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -29.57 -64.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 110.698 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.48 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 11.9 mmmt -50.86 -54.75 21.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.076 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.996 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.4 m-20 -54.69 -61.62 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.567 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.924 ' HA ' ' HB3' ' B' ' 28' ' ' ALA . 9.9 mt -41.15 -45.64 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.757 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.925 ' HB3' ' HB3' ' A' ' 65' ' ' TYR . . . -64.83 -45.59 85.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.721 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.812 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -54.35 -57.09 12.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.949 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.764 ' CE1' ' HB3' ' B' ' 37' ' ' ASP . 0.1 OUTLIER -54.55 -40.47 68.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.97 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.741 HG13 ' O ' ' B' ' 38' ' ' ILE . 49.1 mt -64.5 -68.89 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -40.56 -43.04 1.8 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.79 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.6 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 3.9 mtpp -62.56 -54.31 41.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.5 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 10.4 mt-10 -64.69 -25.1 67.8 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.075 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.801 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -76.96 -46.41 24.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.921 0.391 . . . . 0.0 110.882 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.763 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.3 p30 -66.76 -24.68 66.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.477 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.464 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -89.94 -42.34 11.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.057 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.5 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -80.27 -14.56 58.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.36 -179.584 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.662 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 43.5 m-85 -131.11 -71.16 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.645 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 0.5 OUTLIER 157.39 118.9 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.763 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 26.6 Cg_endo -61.52 170.14 5.87 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.512 2.141 . . . . 0.0 112.347 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.672 ' CG2' ' HB ' ' A' ' 67' ' ' THR . 1.9 m -101.91 136.83 41.07 Favored 'General case' 0 C--N 1.343 0.287 0 C-N-CA 123.044 0.538 . . . . 0.0 110.612 0.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.79 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 56.4 m95 -107.92 105.45 15.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.505 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.786 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 5.9 m170 -78.25 93.83 4.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.767 ' HB3' HD13 ' B' ' 85' ' ' LEU . 0.3 OUTLIER -108.5 140.62 41.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.357 0.599 . . . . 0.0 112.589 -178.017 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.954 HD13 ' HA ' ' A' ' 64' ' ' SER . 19.1 mm -135.56 103.45 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.913 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.674 HG21 ' O ' ' B' ' 82' ' ' ALA . 2.5 p -103.52 125.41 58.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.678 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.743 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.2 -110.62 0.73 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.959 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.694 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 6.9 ptt180 168.74 3.57 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 178.8 29.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.683 0.277 . . . . 0.0 111.461 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.876 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 2.9 p90 -92.96 -167.34 1.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.055 0.455 . . . . 0.0 110.832 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -139.94 86.11 0.21 Allowed Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.833 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.91 ' HA ' HD12 ' A' ' 57' ' ' ILE . 5.8 p -82.33 122.51 28.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.065 0.46 . . . . 0.0 111.32 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.791 ' CD1' ' HA ' ' A' ' 40' ' ' ALA . 46.6 t80 -133.44 83.53 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.426 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.787 ' HB ' ' HB3' ' A' ' 55' ' ' HIS . 7.5 m -118.85 150.34 21.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.632 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 18.4 m -73.18 77.87 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.603 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.45 ' HB2' ' CB ' ' B' ' 73' ' ' PHE . 29.4 p-80 -59.59 169.01 1.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.821 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 178.11 173.54 0.61 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.43 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 1.6 m 75.81 -89.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.775 ' HE2' ' CE1' ' B' ' 72' ' ' HIS . 0.5 OUTLIER 166.53 43.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.775 ' CE1' ' HE2' ' B' ' 71' ' ' LYS . 84.9 m-70 -138.85 31.25 2.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.786 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 7.6 t80 -111.8 79.36 1.21 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.566 179.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.892 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -102.87 123.88 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.173 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.711 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -111.91 137.02 50.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.344 179.645 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.795 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 8.0 p90 -161.18 168.33 24.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.982 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.607 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 47.1 t80 -133.92 115.49 14.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.066 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.96 170.1 11.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.619 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.502 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.09 -48.07 0.05 OUTLIER Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.733 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.439 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -146.45 38.78 1.05 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.877 0.37 . . . . 0.0 110.747 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.751 HG23 ' CD2' ' B' ' 29' ' ' LEU . 76.5 t -152.25 167.67 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.961 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.723 ' N ' HG11 ' B' ' 81' ' ' VAL . . . -134.32 143.18 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.701 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.615 ' HB ' ' CZ ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -135.5 128.9 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.996 0.427 . . . . 0.0 111.212 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.939 HD21 HG12 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -121.15 96.83 5.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.521 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.786 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 1.8 mp -100.09 117.86 35.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.716 ' HA ' ' O ' ' B' ' 72' ' ' HIS . 1.0 OUTLIER -150.99 126.59 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.923 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.79 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.6 OUTLIER -103.7 152.76 21.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.82 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.786 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -111.16 17.64 20.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.255 0.55 . . . . 0.0 110.628 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . 0.471 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.093 0 CA-C-O 118.419 -1.212 . . . . 0.0 112.622 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.921 0.391 . . . . 0.0 110.817 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.084 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.62 166.6 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.646 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.476 ' O ' ' O ' ' A' ' 8' ' ' ILE . 65.2 t -134.52 71.51 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.767 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.851 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -31.86 152.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.947 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.587 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -142.81 -11.63 0.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.501 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.47 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER 179.63 103.88 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.53 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.867 ' HB3' HG13 ' A' ' 74' ' ' ILE . . . -140.02 130.03 24.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.561 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.58 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 27.4 m-20 -121.17 24.15 10.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.304 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.671 ' HG3' ' H ' ' A' ' 14' ' ' SER . 17.0 ttp -104.01 170.47 7.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.794 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.683 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 0.3 OUTLIER -46.82 138.86 5.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.9 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.594 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 24.9 mp0 -50.26 -64.78 0.7 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 6.4 tt0 -58.21 -16.72 14.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.974 0.416 . . . . 0.0 110.097 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.683 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -81.75 -39.15 24.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.669 179.61 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.669 ' CB ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.16 -37.94 84.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.521 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.21 -36.29 61.41 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.526 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 2.1 m-20 -69.5 -35.11 75.23 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.549 178.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.788 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 1.2 t -64.22 -45.37 88.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.728 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.793 HG13 ' HB3' ' A' ' 6' ' ' ALA . 69.5 t -55.97 -51.13 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.327 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -56.93 -34.18 67.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.544 ' HB3' HG21 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -68.88 -34.35 75.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.694 179.131 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.739 ' CB ' HG13 ' A' ' 83' ' ' ILE . . . -72.33 -38.39 68.65 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.806 ' HA ' HD12 ' A' ' 29' ' ' LEU . 34.2 m -67.3 -38.06 84.4 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.711 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.771 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -58.65 -44.31 90.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.512 178.916 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.929 ' HB2' ' HB3' ' A' ' 41' ' ' HIS . . . -72.57 -26.69 61.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.698 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 1.041 HD11 ' HG ' ' A' ' 78' ' ' LEU . 1.6 mt -74.19 -35.82 63.99 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.851 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.94 -28.82 49.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.399 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.771 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 25.5 mmtt -85.2 -33.71 22.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.209 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.666 ' HH ' ' HD1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.4 140.8 16.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.503 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -104.75 29.95 5.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.73 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 39.7 mm -104.92 110.22 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.063 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.502 ' HB3' ' HA3' ' B' ' 63' ' ' GLY . 7.3 mp0 -27.5 -85.83 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.025 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -39.13 -34.45 0.17 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.904 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.73 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 49.2 t0 -66.37 -50.88 62.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.069 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.92 HG23 HD11 ' A' ' 42' ' ' ILE . 5.7 mt -58.84 -43.68 88.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.765 ' HB1' ' CB ' ' B' ' 65' ' ' TYR . . . -60.23 -39.58 87.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.705 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.79 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -65.55 -63.29 1.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.929 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -42.77 -62.54 0.98 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.478 179.531 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.92 HD11 HG23 ' A' ' 38' ' ' ILE . 16.4 mt -45.42 -66.15 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.356 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.649 ' HB3' ' CE2' ' B' ' 65' ' ' TYR . 0.6 OUTLIER -42.25 -66.23 0.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.938 -179.813 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.529 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 5.0 tptp -36.61 -54.09 0.88 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.667 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -57.88 -68.82 0.21 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.728 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.788 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.3 m-85 -37.63 -53.31 1.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.94 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.684 ' OD1' ' HG3' ' A' ' 52' ' ' PRO . 4.5 t70 -54.97 -37.32 66.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.868 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -104.88 11.96 33.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 179.85 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 2.8 mmmt -131.12 11.58 5.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.279 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.621 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 77.8 m-85 -157.58 -63.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.63 0.253 . . . . 0.0 111.487 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.621 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER 164.17 107.87 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.58 -179.644 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.684 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 82.5 Cg_exo -47.27 152.23 2.32 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.37 2.046 . . . . 0.0 112.43 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.693 ' O ' ' HB2' ' A' ' 87' ' ' LYS . 91.0 m -117.88 133.31 56.05 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 123.08 0.552 . . . . 0.0 110.557 -0.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.809 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.5 m95 -97.44 143.93 27.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.173 0.511 . . . . 0.0 111.784 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.742 ' HB3' ' CB ' ' B' ' 66' ' ' VAL . 0.3 OUTLIER -131.93 112.76 12.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.278 179.08 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.786 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 4.4 p -124.84 154.35 41.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.37 0.605 . . . . 0.0 112.596 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.999 HG13 HG13 ' B' ' 57' ' ' ILE . 12.3 mm -131.15 113.22 23.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.234 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.907 HG12 ' HB ' ' A' ' 38' ' ' ILE . 5.5 p -105.02 128.99 58.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.019 0.437 . . . . 0.0 111.184 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.741 ' HA3' ' CD1' ' A' ' 62' ' ' PHE . . . -157.99 170.13 34.8 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.995 -0.621 . . . . 0.0 111.783 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -132.84 34.82 3.6 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.956 0.408 . . . . 0.0 110.887 -179.792 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.521 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 1.1 t-20 169.63 27.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.68 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 1.006 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 20.7 p90 -115.52 -169.83 1.65 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.891 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.35 95.6 0.17 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.916 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.865 ' HA ' HD11 ' B' ' 57' ' ' ILE . 20.0 p -80.99 140.5 35.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.979 0.419 . . . . 0.0 111.539 -179.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.816 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 71.8 t80 -149.13 93.23 2.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.283 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.797 HG21 ' CD2' ' A' ' 86' ' ' PHE . 4.1 m -133.1 149.35 31.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.702 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.748 HG23 HG21 ' B' ' 53' ' ' THR . 1.6 t -79.58 147.31 32.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.679 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 1.006 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -100.92 155.03 18.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.22 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.665 ' HG3' ' OG ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -129.65 -82.48 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.045 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.567 ' C ' ' H ' ' A' ' 72' ' ' HIS . 36.2 m -66.0 -107.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.941 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.571 ' HG3' ' HG3' ' A' ' 13' ' ' MET . 0.0 OUTLIER -69.87 31.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.9 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 1.006 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 1.1 m80 56.61 -91.36 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.636 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.771 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 161.59 -174.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.718 179.756 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.867 HG13 ' HB3' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -154.92 131.76 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.265 -179.986 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.533 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 2.3 t80 -120.61 133.39 55.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.071 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.851 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -151.66 164.73 36.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.94 0.4 . . . . 0.0 111.113 -179.516 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.604 ' O ' ' HD1' ' A' ' 77' ' ' TYR . 4.0 t80 -122.92 92.53 3.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.964 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.084 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.8 mm? -48.12 166.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.692 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -24.47 -54.93 0.05 OUTLIER Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.99 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.72 12.15 3.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.693 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.684 HG12 ' H ' ' A' ' 82' ' ' ALA . 21.8 t -129.58 179.64 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.502 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.684 ' H ' HG12 ' A' ' 81' ' ' VAL . . . -141.19 143.51 34.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.726 0.298 . . . . 0.0 110.67 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.77 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -130.96 125.78 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.739 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.965 HD21 HG12 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -113.12 96.98 6.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.115 179.51 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.771 ' O ' ' HB2' ' A' ' 73' ' ' PHE . 1.7 mp -95.6 128.89 42.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.892 0.377 . . . . 0.0 111.494 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.797 ' CD2' HG21 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -159.84 119.67 2.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.989 179.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.809 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -111.69 149.67 31.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.047 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.694 ' HB2' ' HE1' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 121.326 0.584 . . . . 0.0 110.587 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.783 0.325 . . . . 0.0 111.038 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.76 ' O ' ' HB1' ' B' ' 6' ' ' ALA . 0.0 OUTLIER -47.74 118.51 2.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.763 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.926 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.67 -179.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.765 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.724 HG23 ' O ' ' B' ' 77' ' ' TYR . 41.2 t -145.06 63.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.935 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.5 OUTLIER -33.49 148.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.442 -179.845 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' B' ' 8' ' ' ILE . 13.9 mmtt -148.21 -1.86 0.54 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.929 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.45 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 0.3 OUTLIER -175.22 83.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.761 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.952 ' HB1' HG13 ' B' ' 74' ' ' ILE . . . -123.7 113.51 18.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.831 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.875 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 94.7 m-20 -110.65 37.7 2.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.984 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 17' ' ' MET . 17.3 ttp -125.68 170.97 11.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.075 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.727 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.44 141.84 14.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.827 179.877 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.638 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 17.7 mp0 -50.89 -60.53 2.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.896 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 1.3 mt-10 -54.24 -20.73 7.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.536 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -82.67 -34.57 27.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.866 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 1.004 ' HA ' HD11 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.69 -36.97 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.823 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.759 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 3.2 mp0 -77.06 -40.72 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.529 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 5.0 m-20 -67.05 -34.01 76.77 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.468 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.839 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -65.5 -46.65 78.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.034 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.859 HG12 ' HB1' ' B' ' 6' ' ' ALA . 73.3 t -56.28 -42.38 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.242 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.759 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 24.1 mt-10 -60.6 -39.4 87.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.333 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.52 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 4.1 t -66.51 -32.97 74.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 110.097 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.784 ' HB1' HG22 ' B' ' 83' ' ' ILE . . . -73.22 -32.15 64.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.873 ' HA ' HD12 ' B' ' 29' ' ' LEU . 90.1 m -72.43 -39.53 67.78 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.312 -1.313 . . . . 0.0 109.639 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.771 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 80.7 mm-40 -58.11 -46.1 86.13 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.315 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 1.053 ' HB2' ' HA ' ' B' ' 38' ' ' ILE . . . -67.93 -29.09 68.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.843 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 1.059 HD13 ' HG ' ' B' ' 78' ' ' LEU . 4.5 mt -65.36 -57.11 9.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.664 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -34.48 71.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.803 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.771 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 16.0 mmtt -79.83 -28.78 40.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.676 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.697 ' HH ' ' HD1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -167.56 133.63 2.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.183 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -97.47 26.25 5.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.564 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.982 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 10.3 mm -95.84 109.98 23.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.743 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.891 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 0.5 OUTLIER -29.73 -70.37 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.116 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.599 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -50.67 -56.52 11.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.916 0.388 . . . . 0.0 110.557 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.982 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -43.99 -64.17 0.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.541 179.806 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 1.053 ' HA ' ' HB2' ' B' ' 28' ' ' ALA . 7.0 mt -45.49 -52.96 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.671 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.683 ' CA ' HG12 ' B' ' 58' ' ' VAL . . . -51.4 -39.16 56.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.816 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -66.89 -63.38 1.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.573 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.697 ' HD1' ' HH ' ' B' ' 32' ' ' TYR . 0.5 OUTLIER -42.84 -47.34 5.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.518 179.672 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.761 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 32.5 mt -61.74 -70.44 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.393 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.753 ' HB3' ' CE2' ' A' ' 65' ' ' TYR . 0.5 OUTLIER -36.49 -58.98 0.68 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.478 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 1.6 tttm -51.38 -42.28 61.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.54 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.754 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -70.45 -42.25 71.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.358 -179.458 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.839 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -63.56 -35.78 81.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.014 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.775 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -68.84 -46.43 68.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.698 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.566 ' HZ1' ' HA ' ' B' ' 48' ' ' LYS . 0.1 OUTLIER -78.16 -25.49 47.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.219 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.754 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -89.7 -16.9 29.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.122 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.741 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 53.6 m-85 -125.93 -72.01 0.67 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.455 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.741 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 52.7 t30 160.09 108.55 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.775 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 62.4 Cg_exo -35.02 157.23 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.562 2.174 . . . . 0.0 112.63 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.748 HG21 HG23 ' A' ' 67' ' ' THR . 0.3 OUTLIER -121.92 120.13 33.56 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 122.809 0.444 . . . . 0.0 110.611 -0.005 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.827 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 33.8 m95 -88.69 155.29 19.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.278 0.561 . . . . 0.0 111.491 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.783 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 3.7 m-70 -136.03 99.11 4.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.265 -0.88 . . . . 0.0 108.888 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.949 ' HB3' HD12 ' B' ' 85' ' ' LEU . 2.3 m -108.08 151.51 25.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.999 HG13 HG13 ' A' ' 57' ' ' ILE . 18.1 mm -135.46 108.15 8.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.629 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.954 HG13 ' HB ' ' B' ' 38' ' ' ILE . 2.1 p -111.1 125.78 68.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -178.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.752 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -146.63 -96.1 0.18 Allowed Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.196 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.641 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 16.5 ptt85 169.27 -27.82 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 120.813 0.339 . . . . 0.0 111.088 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.475 ' O ' ' OD1' ' B' ' 61' ' ' ASN . 24.4 t-20 -160.47 42.41 0.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 1.006 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.6 p90 -96.65 -165.02 1.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.875 0.369 . . . . 0.0 110.784 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -141.08 111.57 0.72 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.795 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.933 ' HB2' HD13 ' A' ' 57' ' ' ILE . 88.4 p -101.1 128.32 47.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.084 0.469 . . . . 0.0 111.596 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.79 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 48.0 t80 -136.41 67.62 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.143 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.997 HG11 HD11 ' A' ' 57' ' ' ILE . 10.3 m -103.28 169.86 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.376 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.716 ' HB ' ' CD2' ' A' ' 55' ' ' HIS . 59.6 m -117.34 80.64 1.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.71 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.808 ' HE1' ' HB ' ' B' ' 70' ' ' THR . 59.7 t-80 -57.37 -129.19 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.945 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.735 ' H ' ' HD1' ' B' ' 68' ' ' HIS . 6.7 pt-20 161.32 -47.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.027 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.808 ' HB ' ' HE1' ' B' ' 68' ' ' HIS . 4.0 m -87.73 -111.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.613 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.568 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -56.97 4.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.66 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.875 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 0.1 OUTLIER 72.4 -74.77 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.64 0.257 . . . . 0.0 110.549 -179.879 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.772 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 4.3 p90 154.94 173.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.215 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 1.004 HD11 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -147.17 119.28 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.922 0.391 . . . . 0.0 111.246 179.511 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.751 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 1.4 t80 -103.79 136.55 43.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.351 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.935 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.38 129.19 5.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.975 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.724 ' O ' HG23 ' B' ' 7' ' ' VAL . 2.4 t80 -97.16 113.38 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.059 ' HG ' HD13 ' B' ' 29' ' ' LEU . 0.9 OUTLIER -69.47 170.54 10.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.42 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.506 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.54 -41.55 0.01 OUTLIER Glycine 0 C--N 1.33 0.242 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.958 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.521 ' N ' ' O ' ' B' ' 78' ' ' LEU . 51.6 mt-30 -154.02 35.4 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.88 HG11 ' N ' ' B' ' 82' ' ' ALA . 58.6 t -151.16 170.91 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.024 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.88 ' N ' HG11 ' B' ' 81' ' ' VAL . . . -128.61 154.13 46.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.299 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.784 HG22 ' HB1' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -142.71 126.57 14.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.418 . . . . 0.0 111.56 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.97 HD23 HG12 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -118.57 95.71 4.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.201 179.439 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.949 HD12 ' HB3' ' B' ' 56' ' ' CYS . 1.7 mp -93.65 123.74 37.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.368 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.667 ' CZ ' ' HB ' ' B' ' 66' ' ' VAL . 0.1 OUTLIER -162.53 123.23 2.48 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.558 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.827 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 2.2 ptmt -100.59 143.78 30.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.956 0.407 . . . . 0.0 110.974 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.492 ' H ' ' CD2' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -107.23 18.92 21.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.321 0.581 . . . . 0.0 110.48 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.4 -1.222 . . . . 0.0 112.431 -179.946 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 6' ' ' ALA . 8.1 mmmm . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.743 0.306 . . . . 0.0 110.652 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.094 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 56.72 144.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.216 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.572 HG13 ' HE2' ' A' ' 9' ' ' LYS . 21.4 t -107.69 78.29 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.969 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.981 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -46.38 154.42 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.051 0.453 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.572 ' HE2' HG13 ' A' ' 7' ' ' VAL . 5.6 mmtt -138.53 -19.4 1.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.27 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.511 HD21 ' HA ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -168.27 98.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.535 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.852 ' HB3' ' NE2' ' A' ' 18' ' ' GLN . . . -112.13 75.47 0.92 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.748 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.752 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 7.4 m-20 -75.17 38.54 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.251 0.548 . . . . 0.0 109.618 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.869 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -136.26 172.12 13.47 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.626 -179.113 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.869 ' N ' ' HG2' ' A' ' 13' ' ' MET . 8.3 t -54.24 134.74 44.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.285 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.755 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -51.36 -78.95 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.337 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.494 ' HG2' ' N ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -43.33 -27.42 0.25 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.979 0.419 . . . . 0.0 110.352 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.805 ' HG2' ' CG ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -78.71 -35.06 45.45 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.047 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.852 ' NE2' ' HB3' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -74.58 -31.62 62.12 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.818 0.342 . . . . 0.0 110.398 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -72.28 -40.9 67.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -66.65 -29.67 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.529 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.717 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -66.58 -45.61 78.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.049 179.081 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 1.015 HG13 ' HB2' ' A' ' 6' ' ' ALA . 84.7 t -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.477 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -58.15 -36.84 73.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.953 0.406 . . . . 0.0 110.081 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.8 t -67.37 -32.68 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.047 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.78 ' C ' HD13 ' A' ' 29' ' ' LEU . . . -73.56 -40.27 64.06 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 1.028 ' HA ' HD12 ' A' ' 29' ' ' LEU . 87.1 m -64.55 -37.71 88.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.271 -1.332 . . . . 0.0 109.43 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -61.26 -43.09 99.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.493 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.831 ' HB1' HG22 ' A' ' 38' ' ' ILE . . . -76.69 -14.5 59.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.996 179.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 1.028 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.4 mt -82.53 -44.99 15.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.777 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -34.51 64.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.241 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.493 ' CB ' ' CE1' ' A' ' 32' ' ' TYR . 3.1 mttm -79.13 -28.65 42.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.649 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.633 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.68 149.07 27.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.94 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -116.37 33.53 5.5 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.053 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.941 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 5.7 mm -112.95 107.86 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.964 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.901 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 35.5 mp0 -29.95 -74.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.904 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.483 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -43.54 -59.46 2.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.691 179.767 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.941 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -45.2 -63.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.544 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.831 HG22 ' HB1' ' A' ' 28' ' ' ALA . 7.5 mt -46.79 -52.22 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.126 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.971 ' HB2' ' HB2' ' B' ' 65' ' ' TYR . . . -54.16 -36.7 63.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.101 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.793 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -66.23 -67.28 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.115 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.606 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -46.14 -39.93 10.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.758 HG13 ' O ' ' A' ' 38' ' ' ILE . 65.6 mt -62.8 -66.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.966 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.872 ' HE3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -46.61 -47.05 20.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' A' ' 47' ' ' ASP . 0.8 OUTLIER -52.85 -63.47 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.666 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 4.5 tp10 -45.61 -58.02 3.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.378 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.717 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 2.1 m-85 -52.93 -39.72 63.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.594 179.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.77 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 3.9 t70 -62.12 -24.96 67.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.345 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.787 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -118.4 4.76 11.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.799 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.62 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -107.74 -14.22 14.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.938 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.793 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 5.6 m-85 -145.51 -63.14 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.24 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.793 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 10.7 p-10 157.0 117.16 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.148 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.77 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 13.8 Cg_endo -56.18 174.82 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.47 2.113 . . . . 0.0 112.22 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.967 HG22 HG22 ' B' ' 67' ' ' THR . 23.4 m -103.66 123.16 46.48 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.14 0.576 . . . . 0.0 110.577 0.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.808 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 51.5 m95 -96.77 126.95 42.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.18 0.514 . . . . 0.0 112.181 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.751 ' CB ' HG13 ' B' ' 66' ' ' VAL . 0.0 OUTLIER -106.82 96.99 6.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.504 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.826 ' HB2' HD11 ' A' ' 85' ' ' LEU . 18.9 p -111.4 147.08 35.99 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 1.068 HD11 HG12 ' B' ' 66' ' ' VAL . 18.3 mm -133.03 109.67 14.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.304 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.726 HG13 ' N ' ' A' ' 39' ' ' ALA . 3.1 p -109.42 124.62 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 111.796 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.777 ' O ' HG11 ' A' ' 81' ' ' VAL . . . -146.65 -135.76 2.78 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.061 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -160.89 -20.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.749 0.309 . . . . 0.0 111.312 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.697 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 8.8 m-20 -154.91 35.37 0.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.355 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.913 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 11.2 p90 -101.66 -178.29 3.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.71 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.795 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.73 107.59 0.61 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.82 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 1.02 ' HA ' HD13 ' B' ' 57' ' ' ILE . 53.6 p -92.41 130.37 38.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.207 0.527 . . . . 0.0 111.713 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.795 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 48.5 t80 -136.67 72.06 1.42 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.099 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.809 HG13 HD12 ' B' ' 57' ' ' ILE . 5.9 m -122.38 136.53 58.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.294 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.774 HG22 ' O ' ' A' ' 67' ' ' THR . 7.0 t -67.94 116.78 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.972 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.46 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 21.4 p-80 -87.21 162.83 17.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.736 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.71 ' O ' HG21 ' A' ' 70' ' ' THR . 6.3 pt-20 -158.57 -153.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.949 0.404 . . . . 0.0 111.166 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.71 HG21 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 44.06 -92.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.751 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 170.64 21.02 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.659 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.848 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 25.5 m-70 -125.18 61.96 1.18 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.12 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.752 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 7.4 t80 -130.76 97.82 4.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.933 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.863 HG23 ' HE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -115.42 122.88 70.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.804 -179.163 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.588 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 8.0 t80 -114.04 137.11 52.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.299 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.981 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -161.0 173.23 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.183 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.693 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 89.2 t80 -132.87 92.47 3.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.908 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.094 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.1 mm? -42.75 169.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.59 -44.14 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.424 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.443 ' O ' ' OE1' ' A' ' 80' ' ' GLN . 0.9 OUTLIER -148.37 32.62 0.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.777 HG11 ' O ' ' A' ' 59' ' ' GLY . 76.4 t -147.46 171.66 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.65 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.76 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -133.51 144.79 49.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.82 0.343 . . . . 0.0 110.745 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.721 HD12 ' C ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -134.53 124.64 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.077 -179.752 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.773 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -112.72 88.34 2.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.556 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.826 HD11 ' HB2' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -93.35 124.19 37.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.472 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.73 ' CE1' ' HB2' ' A' ' 55' ' ' HIS . 2.5 p90 -164.11 129.04 2.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.591 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.793 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.53 161.59 13.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.503 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.737 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 0.0 110.434 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.543 HH11 ' CB ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.735 0.302 . . . . 0.0 110.682 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.543 ' O ' ' HD2' ' B' ' 5' ' ' LYS . 0.0 OUTLIER -112.02 40.52 2.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.085 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -115.42 -170.92 1.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.336 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.84 HG13 ' HE3' ' B' ' 9' ' ' LYS . 26.8 t -137.98 66.69 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.799 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.9 OUTLIER -37.21 157.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.132 0.491 . . . . 0.0 110.663 -179.829 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.84 ' HE3' HG13 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -154.44 -11.4 0.13 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.201 179.722 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.519 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.2 OUTLIER -166.8 100.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.433 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.931 ' HB2' HG13 ' B' ' 74' ' ' ILE . . . -128.77 136.77 50.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.019 0.438 . . . . 0.0 111.599 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.572 ' CB ' ' HD2' ' B' ' 68' ' ' HIS . 21.1 t70 -132.63 28.7 4.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.774 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.83 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 13.5 ttp -123.98 151.58 43.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.856 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.778 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 2.1 m -36.52 141.39 0.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.942 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' B' ' 18' ' ' GLN . 11.9 mt-10 -46.94 -66.45 0.4 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.184 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.681 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -50.93 -30.57 15.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.773 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.769 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.13 -40.75 74.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.743 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.778 ' HG2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -66.78 -28.67 68.58 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.849 0.357 . . . . 0.0 110.469 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.681 ' HG2' ' O ' ' B' ' 16' ' ' GLU . 2.6 pt20 -77.36 -42.55 36.08 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.61 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 1.1 m-20 -69.9 -25.03 63.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.79 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.86 ' HG ' HG21 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -70.87 -51.52 25.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.196 179.278 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.83 HG13 ' HB1' ' B' ' 6' ' ' ALA . 60.9 t -57.17 -42.39 79.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.244 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.541 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 8.7 mt-10 -61.42 -38.88 88.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.077 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.443 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 65.9 m -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.964 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.843 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -70.23 -33.63 71.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.742 ' HA ' HD12 ' B' ' 29' ' ' LEU . 1.4 m -66.84 -40.76 88.05 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.43 -1.259 . . . . 0.0 109.487 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 5.6 mt-30 -56.57 -44.92 81.46 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.562 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.856 ' HB1' ' HD1' ' B' ' 41' ' ' HIS . . . -80.25 -15.23 57.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.565 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.742 HD12 ' HA ' ' B' ' 26' ' ' THR . 5.7 mt -82.57 -35.71 26.9 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . 0.653 ' OE1' ' HD2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -88.07 -30.19 20.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.188 -179.717 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.653 ' HD2' ' OE1' ' B' ' 30' ' ' GLU . 1.7 mptt -84.39 -9.75 58.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.834 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.613 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.1 OUTLIER -151.1 -150.09 0.33 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.975 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.514 HD21 ' HA ' ' B' ' 33' ' ' ASN . 0.0 OUTLIER 177.87 28.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.609 179.843 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 1.028 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.8 mm -117.8 106.4 19.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.509 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.795 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 2.3 mp0 -29.67 -62.65 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.924 0.392 . . . . 0.0 110.731 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.5 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -55.1 -51.97 64.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.017 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 1.028 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.5 m-20 -54.44 -61.3 2.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.828 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.86 HG22 HD13 ' B' ' 42' ' ' ILE . 2.5 mt -45.78 -48.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.008 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.663 ' HB2' ' CB ' ' A' ' 65' ' ' TYR . . . -62.42 -34.2 76.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.795 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -62.4 -62.91 1.43 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.034 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.856 ' HD1' ' HB1' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -53.72 -54.13 42.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.939 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.86 HD13 HG22 ' B' ' 38' ' ' ILE . 73.7 mt -44.06 -66.65 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.277 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.701 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 13.2 tttp -42.82 -50.97 5.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.903 0.382 . . . . 0.0 110.917 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.631 ' HZ3' ' HB3' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -55.9 -45.9 78.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.219 -179.79 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.663 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.0 mt-10 -68.09 -34.88 77.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.15 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.781 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -72.32 -32.63 66.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.991 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.707 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 5.1 m-20 -71.31 -38.0 71.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.915 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.438 ' HZ1' ' HG2' ' B' ' 48' ' ' LYS . 0.1 OUTLIER -90.48 -23.67 20.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.688 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.663 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.4 OUTLIER -86.03 -20.53 28.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.359 -179.562 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.557 ' HD2' ' O ' ' B' ' 46' ' ' PHE . 12.7 m-85 -132.09 -66.82 0.69 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.617 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.492 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 3.4 t-20 158.93 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.395 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.707 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 20.8 Cg_endo -60.3 171.61 3.11 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.307 2.005 . . . . 0.0 112.333 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.764 HG22 HG23 ' A' ' 67' ' ' THR . 62.9 m -104.74 131.57 52.02 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 122.917 0.487 . . . . 0.0 111.052 0.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.809 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 46.2 m95 -102.2 157.58 16.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.591 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.767 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 10.2 m-70 -128.91 99.57 5.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.755 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.908 ' HB3' HD11 ' B' ' 85' ' ' LEU . 1.8 m -106.26 128.26 53.84 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 1.02 HD13 ' HA ' ' A' ' 64' ' ' SER . 17.0 mm -125.32 101.38 8.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.501 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.744 ' HB ' HG22 ' B' ' 83' ' ' ILE . 2.7 p -108.77 126.24 65.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 0.0 111.85 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.747 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.08 -105.29 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.795 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.795 ' HG3' HD21 ' B' ' 61' ' ' ASN . 0.4 OUTLIER 170.91 -33.26 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.67 0.271 . . . . 0.0 111.194 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.795 HD21 ' HG3' ' B' ' 60' ' ' ARG . 7.0 m-80 -145.02 46.72 1.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.125 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.913 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 21.3 p90 -111.0 -173.54 2.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.904 0.383 . . . . 0.0 110.76 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.901 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -138.0 98.53 0.26 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.778 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.844 ' HA ' HD12 ' A' ' 57' ' ' ILE . 1.2 p -86.81 121.99 30.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.223 0.535 . . . . 0.0 111.591 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.971 ' HB2' ' HB2' ' A' ' 39' ' ' ALA . 21.8 t80 -129.14 75.53 1.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 1.068 HG12 HD11 ' A' ' 57' ' ' ILE . 28.4 m -123.48 164.62 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.336 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.967 HG22 HG22 ' A' ' 53' ' ' THR . 5.3 t -82.91 128.17 34.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.669 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.62 ' H ' ' HD1' ' B' ' 68' ' ' HIS . 1.8 p-80 -104.11 118.57 36.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.534 ' O ' ' HB ' ' B' ' 70' ' ' THR . 0.8 OUTLIER -123.29 168.73 12.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.707 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.584 HG22 ' CD2' ' B' ' 72' ' ' HIS . 29.0 m 76.13 -100.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.716 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.622 ' O ' ' HA ' ' B' ' 13' ' ' MET . 2.3 ttpt 173.33 38.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.798 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.83 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 3.2 m-70 -138.66 46.87 1.97 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.782 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 4.8 t80 -120.69 87.67 2.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.404 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.931 HG13 ' HB2' ' B' ' 11' ' ' ALA . 1.2 tt -105.48 144.91 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.045 0.45 . . . . 0.0 111.632 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.8 OUTLIER -134.1 131.18 38.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.195 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.799 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 9.7 p90 -158.54 161.7 37.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.991 0.425 . . . . 0.0 111.258 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.669 ' O ' HG21 ' B' ' 7' ' ' VAL . 8.0 t80 -122.23 111.02 16.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.411 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.085 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.41 169.97 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.767 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -23.39 -45.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 113.15 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.696 ' O ' HG21 ' B' ' 81' ' ' VAL . 14.3 tt0 -151.4 36.74 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.752 0.311 . . . . 0.0 110.937 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.768 HG11 ' N ' ' B' ' 82' ' ' ALA . 86.0 t -152.12 170.18 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.184 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.768 ' N ' HG11 ' B' ' 81' ' ' VAL . . . -133.85 149.94 51.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.843 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -140.11 131.56 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.188 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.762 HD22 HG12 ' B' ' 57' ' ' ILE . 2.0 tp -121.34 88.58 2.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.908 HD11 ' HB3' ' B' ' 56' ' ' CYS . 1.3 mp -92.93 124.54 36.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.069 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.771 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 12.1 p90 -162.72 132.83 4.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.349 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.799 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -93.82 151.87 19.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.534 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.666 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.1 OUTLIER -113.99 19.72 16.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.314 0.578 . . . . 0.0 110.17 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.397 -1.224 . . . . 0.0 112.436 -179.866 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.726 ' O ' HD11 ' A' ' 78' ' ' LEU . 6.1 tptm . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.877 0.37 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.062 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -136.5 175.3 9.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.212 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.504 ' O ' ' HE3' ' A' ' 9' ' ' LYS . 95.9 t -137.31 77.94 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.758 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.782 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 1.2 mp -32.78 148.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.334 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.757 ' HB2' ' CD2' ' A' ' 75' ' ' TYR . 5.0 mmtp -129.45 -14.19 4.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.847 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.43 ' HB3' ' H ' ' A' ' 11' ' ' ALA . 1.7 t30 -164.09 -91.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.483 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.991 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 70.09 -173.96 0.18 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.577 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.596 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 2.8 t0 166.62 28.51 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.471 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.64 ' HG3' ' H ' ' A' ' 14' ' ' SER . 15.4 ttp -113.76 171.58 7.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.674 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.905 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 1.9 m -48.35 129.17 15.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.877 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.469 ' H ' ' HG2' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -34.39 -79.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.795 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.627 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 2.1 mm-40 -46.07 -22.89 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.905 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -76.14 -39.89 53.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.549 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.665 ' HG2' ' O ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -68.47 -38.16 80.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.495 179.625 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.43 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 1.0 OUTLIER -72.98 -36.74 67.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.566 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.627 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.4 t0 -66.78 -39.58 87.86 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.84 179.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.998 ' HB2' HD23 ' A' ' 85' ' ' LEU . 1.1 p -60.35 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.74 178.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.802 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 40.1 t -52.74 -50.24 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.303 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 54.2 mt-10 -54.3 -46.78 72.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.22 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.438 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 20.0 m -59.29 -37.31 77.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.034 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.952 ' HB3' HG23 ' A' ' 83' ' ' ILE . . . -69.04 -28.32 66.45 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.514 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.8 m -72.93 -39.43 66.28 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.4 -1.273 . . . . 0.0 109.54 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.683 ' O ' ' HD3' ' A' ' 31' ' ' LYS . 6.3 mm-40 -56.79 -43.22 80.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.406 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.9 ' HB3' ' HB3' ' A' ' 41' ' ' HIS . . . -75.99 -29.94 58.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.178 179.039 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.657 ' HG ' ' CG2' ' A' ' 38' ' ' ILE . 3.1 mt -72.71 -30.52 64.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.212 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -95.96 -16.11 21.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.831 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.683 ' HD3' ' O ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -92.5 -23.93 18.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.551 ' HE1' ' HA ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -163.49 134.84 4.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.754 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -96.11 39.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.894 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.709 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 40.2 mm -117.59 102.16 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.001 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.643 ' OE2' ' HD3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -22.25 -89.43 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.423 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -37.03 -42.88 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.727 179.967 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.709 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 24.2 t0 -57.96 -56.54 20.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.517 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.764 HG22 ' HB1' ' A' ' 28' ' ' ALA . 9.8 mt -52.04 -45.72 41.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.649 ' HB3' HG12 ' A' ' 58' ' ' VAL . . . -61.87 -45.72 92.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.794 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -56.2 -64.34 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.286 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.9 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -38.8 -52.68 1.72 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.02 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.751 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 16.9 mt -55.91 -68.17 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.203 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.617 ' HE2' ' C ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -37.34 -63.03 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.204 -179.848 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.438 ' HA ' ' HZ3' ' A' ' 43' ' ' LYS . 4.9 tttt -43.92 -57.19 3.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.418 . . . . 0.0 111.037 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.586 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -53.51 -57.03 12.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.205 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.781 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -55.03 -34.82 63.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.541 ' HB2' ' CE ' ' A' ' 43' ' ' LYS . 17.6 t70 -73.54 -20.88 60.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.57 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.719 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -121.38 10.53 10.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.586 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.8 OUTLIER -128.18 3.35 5.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.547 -179.431 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.569 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 95.7 m-85 -147.07 -63.12 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.509 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 18.8 p-10 161.56 110.87 0.01 OUTLIER Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.109 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.498 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 86.1 Cg_exo -45.96 151.06 1.55 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.311 2.008 . . . . 0.0 112.578 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.651 ' O ' ' HB2' ' A' ' 87' ' ' LYS . 95.1 m -118.74 136.17 54.11 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.162 0.585 . . . . 0.0 110.353 -0.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.787 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 65.3 m95 -101.48 144.8 29.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.27 0.557 . . . . 0.0 111.993 -179.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.75 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.2 OUTLIER -130.26 103.39 6.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.847 178.854 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.805 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.37 162.64 18.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.404 0.621 . . . . 0.0 112.496 -178.176 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.931 HG23 ' HA ' ' B' ' 64' ' ' SER . 26.2 mm -131.77 172.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.977 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.855 ' H ' HG21 ' A' ' 57' ' ' ILE . 7.3 p -169.33 114.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.946 0.403 . . . . 0.0 111.563 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.557 ' HA2' ' CG ' ' A' ' 35' ' ' GLU . . . -141.07 -140.06 3.78 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.801 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.643 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -162.78 6.09 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.427 ' O ' ' OE2' ' B' ' 35' ' ' GLU . 0.6 OUTLIER -179.99 32.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.76 0.314 . . . . 0.0 111.205 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.943 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -101.12 -169.1 1.65 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.097 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.585 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.41 93.98 0.17 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.849 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.807 ' HB2' HD12 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -82.72 134.15 35.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 0.0 111.498 -179.244 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.781 ' HB2' ' HB1' ' B' ' 39' ' ' ALA . 19.7 t80 -143.34 65.29 1.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.256 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.757 ' CG1' ' HB3' ' B' ' 55' ' ' HIS . 2.8 m -113.94 153.7 15.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.357 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.783 HG21 HG23 ' B' ' 53' ' ' THR . 3.4 t -62.57 -162.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.951 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.63 ' HD1' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -156.85 150.16 24.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.915 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.707 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -143.48 175.03 10.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 179.894 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.59 ' C ' ' H ' ' A' ' 72' ' ' HIS . 3.5 m 42.37 -114.57 0.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.662 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.752 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 4.2 mmtm -69.87 24.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.754 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 51.1 m-70 62.54 -88.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.69 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.756 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.2 OUTLIER 162.58 -169.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.604 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.991 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -161.12 141.37 3.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.443 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.757 ' CD2' ' HB2' ' A' ' 9' ' ' LYS . 7.8 t80 -131.54 139.47 49.25 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.787 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.802 ' CE2' ' HA ' ' A' ' 22' ' ' VAL . 0.2 OUTLIER -161.55 176.42 11.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.845 0.355 . . . . 0.0 111.097 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.739 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 42.4 t80 -135.48 97.21 3.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.201 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.062 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -60.3 -169.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.457 179.695 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.561 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -61.73 93.08 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.07 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.561 ' HB2' ' O ' ' A' ' 79' ' ' GLY . 4.8 mm100 71.1 15.9 6.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.117 0.484 . . . . 0.0 110.268 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.873 HG11 ' N ' ' A' ' 82' ' ' ALA . 55.2 t -136.84 164.91 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.775 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.873 ' N ' HG11 ' A' ' 81' ' ' VAL . . . -138.37 151.87 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.69 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.952 HG23 ' HB3' ' A' ' 25' ' ' ALA . 0.2 OUTLIER -140.41 126.42 21.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.884 0.374 . . . . 0.0 111.398 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.861 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 0.9 OUTLIER -112.02 93.37 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.998 HD23 ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -92.21 147.44 22.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.173 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.715 ' CE2' HG12 ' B' ' 66' ' ' VAL . 5.9 p90 179.33 119.02 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.182 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.787 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 2.3 ptmt -101.12 150.97 22.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.724 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-O 121.242 0.544 . . . . 0.0 110.911 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.46 ' HD2' HE22 ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.874 0.368 . . . . 0.0 110.831 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.743 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.6 OUTLIER 32.49 40.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.261 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.038 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -131.78 -176.27 3.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.278 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.557 ' N ' ' O ' ' B' ' 77' ' ' TYR . 45.0 t -145.73 72.41 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.922 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.789 HD11 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -33.15 147.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 110.583 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.548 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 0.5 OUTLIER -134.35 -12.39 2.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.686 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' B' ' 9' ' ' LYS . 0.1 OUTLIER 173.6 103.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.826 -179.719 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.673 ' HB2' ' HG2' ' B' ' 18' ' ' GLN . . . -130.4 154.12 48.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.454 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.928 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 26.6 m-20 -146.98 27.51 1.06 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.339 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.89 ' SD ' ' HG3' ' B' ' 71' ' ' LYS . 10.7 ttp -108.26 178.02 4.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.598 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.757 ' H ' ' HG3' ' B' ' 13' ' ' MET . 3.5 m -58.76 128.6 38.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.806 0.336 . . . . 0.0 111.015 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.662 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . 1.6 mt-10 -33.35 -70.06 0.08 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.759 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 3.4 mm-40 -55.22 -26.51 39.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.272 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.764 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 38.5 mmm -72.56 -34.67 67.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.822 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.953 ' HB3' HD13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.41 -48.62 39.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.022 0.439 . . . . 0.0 110.663 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.774 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 2.2 mm100 -68.3 -23.43 64.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.78 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER -79.11 -34.89 43.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.86 179.166 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.796 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 0.2 OUTLIER -65.96 -41.49 91.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.883 179.075 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.763 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 95.4 t -63.85 -50.17 78.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.262 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.774 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 39.7 mt-10 -51.94 -40.91 61.56 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.491 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.757 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 48.6 t -66.7 -37.59 85.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.321 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.979 ' HA ' HD12 ' B' ' 42' ' ' ILE . . . -69.56 -28.8 66.29 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.535 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 4.7 m -70.82 -43.31 68.88 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 114.329 -1.305 . . . . 0.0 109.513 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.757 ' HG3' ' HA ' ' B' ' 24' ' ' CYS . 6.1 mt-30 -53.5 -47.3 69.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.717 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.966 ' HB2' HG22 ' B' ' 38' ' ' ILE . . . -76.21 -20.19 57.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.632 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.835 HD11 ' HG ' ' B' ' 78' ' ' LEU . 5.9 mt -74.89 -39.89 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.272 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.47 -30.56 27.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.382 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.542 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 7.2 mttt -82.04 -33.34 30.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.0 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.625 ' CG ' ' HE1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -144.44 157.12 44.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.721 HD21 HD11 ' B' ' 34' ' ' ILE . 0.3 OUTLIER -123.54 29.36 6.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.214 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 1.086 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 4.0 mm -107.68 108.0 24.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.585 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 0.3 OUTLIER -29.79 -71.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.132 -179.512 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.424 ' H ' ' HG2' ' B' ' 36' ' ' LYS . 0.5 OUTLIER -50.03 -54.67 18.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.866 0.365 . . . . 0.0 110.647 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 1.086 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.3 m-20 -46.11 -64.65 0.7 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.966 HG22 ' HB2' ' B' ' 28' ' ' ALA . 4.8 mt -44.56 -56.01 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.253 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.781 ' HB1' ' HB2' ' A' ' 65' ' ' TYR . . . -55.88 -38.32 70.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.471 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.748 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -57.59 -58.83 6.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.218 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.625 ' HE1' ' CG ' ' B' ' 32' ' ' TYR . 0.1 OUTLIER -58.07 -33.93 69.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.13 -179.82 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.979 HD12 ' HA ' ' B' ' 25' ' ' ALA . 62.5 mt -66.05 -69.51 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.55 ' HB3' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -45.11 -37.28 4.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.962 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.593 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 43.3 mmtt -71.14 -51.67 23.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 111.023 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.6 mt-10 -62.69 -25.58 68.23 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.947 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.796 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -75.61 -47.49 26.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.617 179.912 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.71 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.9 OUTLIER -64.94 -24.68 67.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.304 179.642 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.7 ' HE2' ' C ' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -89.85 -42.76 11.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.625 179.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.674 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.8 tttp -83.0 -14.17 54.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.05 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.78 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 58.0 m-85 -128.88 -71.38 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.435 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.714 HD21 ' HD2' ' B' ' 52' ' ' PRO . 1.9 t-20 156.22 119.22 0.0 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.18 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.714 ' HD2' HD21 ' B' ' 51' ' ' ASN . 19.0 Cg_endo -59.23 168.9 4.27 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 122.495 2.13 . . . . 0.0 112.661 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.783 HG23 HG21 ' A' ' 67' ' ' THR . 1.7 t -108.5 125.31 51.66 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 122.885 0.474 . . . . 0.0 110.54 0.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.812 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 42.8 m95 -95.92 168.56 10.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.584 0.707 . . . . 0.0 112.107 -179.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.757 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 8.4 m-70 -131.09 96.19 3.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.584 178.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.726 ' SG ' HG21 ' B' ' 42' ' ' ILE . 78.9 m -104.44 122.49 45.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.201 0.524 . . . . 0.0 112.116 -178.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.755 HD12 ' CD2' ' A' ' 84' ' ' LEU . 7.7 mt -127.77 109.16 19.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.382 179.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.848 HG13 ' HB ' ' B' ' 38' ' ' ILE . 1.6 p -111.04 118.65 57.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.321 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.685 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -138.79 -126.15 2.37 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.889 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.735 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -169.7 10.03 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.687 0.28 . . . . 0.0 111.147 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.735 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.1 OUTLIER 163.64 32.82 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.994 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.943 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.2 p90 -82.86 173.08 12.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.023 0.439 . . . . 0.0 111.004 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.94 76.88 0.32 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.894 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.931 ' HA ' HG23 ' A' ' 57' ' ' ILE . 53.1 p -72.52 122.2 20.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 0.0 111.415 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.854 ' H ' HD12 ' A' ' 57' ' ' ILE . 23.3 t80 -133.92 77.39 1.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.309 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.849 HG11 HD11 ' A' ' 57' ' ' ILE . 6.1 m -115.14 163.89 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.497 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.624 ' O ' HG21 ' B' ' 67' ' ' THR . 19.7 m -95.62 73.33 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.464 179.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.636 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 2.9 p-80 -46.57 179.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.4 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.636 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -179.49 -177.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.467 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.558 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 56.13 -120.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.818 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.89 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.72 17.42 0.07 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.943 0.402 . . . . 0.0 110.672 179.82 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.928 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 7.0 m-70 68.53 -90.36 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.827 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.727 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 1.0 OUTLIER 157.87 -164.68 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.566 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.953 HD13 ' HB3' ' B' ' 18' ' ' GLN . 0.2 OUTLIER -162.76 116.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.504 ' OH ' ' CZ ' ' B' ' 62' ' ' PHE . 1.1 t80 -107.02 134.65 49.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.29 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.789 ' HB3' HD11 ' B' ' 8' ' ' ILE . 2.9 p90 -152.35 165.34 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.086 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.577 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 26.7 t80 -126.33 108.95 11.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.038 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -69.86 170.47 11.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.763 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.477 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.97 -37.34 0.01 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.917 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.699 ' O ' HG22 ' B' ' 81' ' ' VAL . 4.6 tt0 -158.5 41.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.745 0.307 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.91 HG12 ' N ' ' B' ' 82' ' ' ALA . 69.8 t -157.79 164.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.009 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.91 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -133.44 111.74 10.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.662 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.656 ' CG1' HD22 ' B' ' 78' ' ' LEU . 0.1 OUTLIER -101.33 133.37 44.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.973 0.416 . . . . 0.0 111.482 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.739 HD13 ' HG ' ' B' ' 64' ' ' SER . 0.1 OUTLIER -119.74 103.92 9.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.156 179.628 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.727 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 4.3 mp -107.22 117.11 33.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.52 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.683 ' HE2' HD21 ' B' ' 84' ' ' LEU . 25.1 p90 -153.34 138.39 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.925 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.812 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 5.3 mtpm? -100.65 159.63 15.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 111.207 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.601 ' HB2' ' HE2' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -98.43 19.33 14.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.818 -179.891 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . 0.409 ' CA ' ' OG1' ' B' ' 70' ' ' THR . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.424 -1.209 . . . . 0.0 112.567 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.446 ' C ' HD13 ' A' ' 78' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.968 0.413 . . . . 0.0 110.73 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -123.9 -178.82 4.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.205 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 77' ' ' TYR . 93.3 t -133.92 73.86 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.009 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.831 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -39.59 155.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.267 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.783 ' HA ' ' HZ2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -146.41 -10.03 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.567 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.442 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER 179.11 97.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.632 179.813 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 1.013 ' HB2' HG13 ' A' ' 74' ' ' ILE . . . -127.44 94.95 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.666 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 72' ' ' HIS . 88.1 m-20 -90.33 30.93 1.05 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.285 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.893 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.1 OUTLIER -116.59 166.83 11.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.644 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.874 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -45.65 122.94 3.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.797 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.609 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -38.01 -73.58 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.948 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.471 ' OE1' ' HA ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -44.52 -28.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.754 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.893 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -73.02 -43.63 61.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.812 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.743 ' CB ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -59.9 -36.39 76.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.725 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.461 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 6.7 mt-30 -75.43 -39.77 58.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.137 0.494 . . . . 0.0 109.923 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.41 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -68.48 -29.01 67.53 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.41 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.821 ' HG ' HG23 ' A' ' 74' ' ' ILE . 0.1 OUTLIER -68.53 -45.92 70.95 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.785 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.682 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 17.4 t -56.55 -44.19 80.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.211 178.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 62.0 mt-10 -59.61 -41.58 90.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.269 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.742 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 53.6 t -65.08 -34.69 79.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.257 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.648 ' HA ' HD13 ' A' ' 42' ' ' ILE . . . -73.14 -32.98 65.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.945 ' HA ' HD11 ' A' ' 29' ' ' LEU . 23.5 m -70.22 -36.9 74.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.565 178.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.794 ' HB3' ' NE2' ' A' ' 41' ' ' HIS . 0.2 OUTLIER -62.31 -42.28 99.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.758 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.864 ' HB3' ' HA ' ' A' ' 38' ' ' ILE . . . -69.88 -28.94 66.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.859 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.945 HD11 ' HA ' ' A' ' 26' ' ' THR . 1.5 mt -71.12 -58.7 3.3 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.813 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -36.61 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.859 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.772 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 15.1 mmtp -79.45 -35.77 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.887 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.605 ' HE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -153.56 152.11 30.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.886 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.918 ' HA ' HD11 ' A' ' 38' ' ' ILE . 4.7 m120 -128.46 40.37 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.534 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.603 ' O ' ' N ' ' A' ' 36' ' ' LYS . 33.2 mm -107.5 49.26 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.232 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.837 ' HG3' ' HA2' ' A' ' 59' ' ' GLY . 0.0 OUTLIER 34.72 -89.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.378 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.603 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -41.33 -46.9 3.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.987 0.422 . . . . 0.0 110.52 179.338 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.587 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 61.0 t0 -54.19 -61.13 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.81 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.918 HD11 ' HA ' ' A' ' 33' ' ' ASN . 3.5 mt -48.12 -50.72 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.078 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 1.03 ' HB2' ' HB2' ' B' ' 65' ' ' TYR . . . -52.13 -51.47 57.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.791 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -52.79 -51.31 61.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.698 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.86 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 0.6 OUTLIER -52.14 -47.0 65.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.55 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.742 ' HA ' ' SG ' ' A' ' 24' ' ' CYS . 37.1 mt -55.17 -71.88 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.189 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.766 ' HB3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -37.61 -55.2 1.14 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.997 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -44.26 -62.35 1.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.13 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.751 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 1.3 tp10 -55.54 -62.04 1.95 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.091 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.815 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.1 m-85 -41.67 -49.61 4.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.949 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.765 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 1.6 m-20 -56.58 -39.74 74.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.1 6.54 43.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.248 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.751 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -108.89 -20.72 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.098 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.718 ' HH ' ' HZ1' ' A' ' 49' ' ' LYS . 14.1 m-85 -140.62 -58.55 0.52 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.417 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.65 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 0.4 OUTLIER 159.21 118.37 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.292 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.765 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 29.3 Cg_endo -62.39 171.37 5.48 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 122.561 2.174 . . . . 0.0 112.407 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.781 HG22 HG23 ' B' ' 67' ' ' THR . 20.6 m -104.9 134.46 47.97 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 122.981 0.512 . . . . 0.0 110.648 0.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.814 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.6 m95 -105.7 145.45 31.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.49 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.851 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 5.6 m170 -121.69 101.8 7.81 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.764 ' HB3' HD11 ' A' ' 85' ' ' LEU . 8.6 p -107.66 146.79 31.56 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 1.005 HD12 ' HB2' ' B' ' 64' ' ' SER . 29.6 mm -134.47 107.37 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.548 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.778 HG12 ' HB3' ' A' ' 39' ' ' ALA . 7.2 p -107.86 116.35 51.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.545 -179.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.837 ' HA2' ' HG3' ' A' ' 35' ' ' GLU . . . -134.97 -134.11 3.35 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.192 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.71 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -167.36 11.12 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 120.827 0.346 . . . . 0.0 111.137 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.71 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 29.1 t-20 165.55 31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.894 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 3.0 p90 -91.32 -175.28 4.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.781 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.652 ' N ' ' HD1' ' A' ' 62' ' ' PHE . . . -138.41 101.32 0.32 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.87 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.914 ' HB2' HD11 ' B' ' 57' ' ' ILE . 87.6 p -87.45 144.88 26.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.196 0.522 . . . . 0.0 111.72 -179.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.723 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 22.9 t80 -152.2 64.95 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.803 HG12 HD12 ' B' ' 57' ' ' ILE . 27.2 m -104.8 160.73 5.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.6 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.489 ' OG1' ' OG1' ' B' ' 53' ' ' THR . 2.3 m -87.0 -17.79 32.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.96 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.828 ' HB3' ' HB2' ' A' ' 86' ' ' PHE . 6.4 p-80 35.55 -157.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.714 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER 167.6 -155.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.91 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.489 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 41.65 -98.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.671 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.571 ' O ' ' HB2' ' A' ' 13' ' ' MET . 1.4 mmtp -91.27 32.83 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.712 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.728 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.0 OUTLIER 52.99 -88.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.95 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.728 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 28.0 p90 165.46 -174.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.007 0.432 . . . . 0.0 111.125 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 1.013 HG13 ' HB2' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -154.03 129.69 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.887 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.582 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -117.05 137.23 52.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.496 179.644 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.831 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -162.46 163.7 27.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.902 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.769 ' HE1' ' HA ' ' A' ' 80' ' ' GLN . 6.3 t80 -130.55 103.64 6.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.156 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.0 mm? -60.21 -178.82 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.833 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.02 -53.56 0.08 OUTLIER Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.54 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.769 ' HA ' ' HE1' ' A' ' 77' ' ' TYR . 0.3 OUTLIER -147.77 34.47 0.84 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.014 0.435 . . . . 0.0 110.415 179.468 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.915 HG13 ' H ' ' A' ' 82' ' ' ALA . 91.5 t -143.69 167.61 12.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.912 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.915 ' H ' HG13 ' A' ' 81' ' ' VAL . . . -131.68 151.97 51.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.542 179.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.633 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -138.84 134.06 42.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.995 0.426 . . . . 0.0 111.375 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.735 HD23 ' HB2' ' A' ' 64' ' ' SER . 0.3 OUTLIER -122.5 91.65 3.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.957 179.532 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.764 HD11 ' HB3' ' A' ' 56' ' ' CYS . 2.1 mp -93.71 125.28 38.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.63 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.828 ' HB2' ' HB3' ' A' ' 68' ' ' HIS . 27.9 p90 -158.95 122.54 3.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.814 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 40.3 mtpt -80.4 165.44 22.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.615 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.851 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 121.243 0.544 . . . . 0.0 110.634 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.847 HH11 ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.997 0.427 . . . . 0.0 110.723 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.608 ' O ' ' HB2' ' B' ' 6' ' ' ALA . 0.1 OUTLIER -42.67 129.66 4.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.051 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 0.739 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.93 165.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.88 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.657 HG13 ' HE2' ' B' ' 9' ' ' LYS . 71.7 t -132.17 66.98 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.945 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.948 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.08 153.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.185 0.517 . . . . 0.0 110.731 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.759 ' N ' HG22 ' B' ' 8' ' ' ILE . 0.9 OUTLIER -154.01 -4.95 0.17 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.565 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.1 OUTLIER -173.12 86.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.361 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 1.043 ' HB3' HG13 ' B' ' 74' ' ' ILE . . . -121.24 84.71 2.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.947 -179.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 0.3 OUTLIER -75.9 40.57 0.2 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.408 179.205 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.706 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 16.5 ttp -132.11 166.21 22.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.784 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.0 m -52.25 143.56 14.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.929 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.491 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 10.9 mt-10 -48.31 -65.82 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.993 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.74 -29.25 17.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.852 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.735 ' HE1' ' CH2' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -72.98 -32.04 64.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.784 ' HG2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -76.1 -34.87 59.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.674 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.652 ' HG3' ' NH1' ' B' ' 4' ' ' ARG . 2.6 mp0 -75.8 -38.28 58.35 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.36 -30.85 66.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.652 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.765 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 77.5 p -67.77 -44.48 77.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.819 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.705 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 81.4 t -59.48 -50.19 80.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.477 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -55.0 -40.64 70.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.305 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 9.1 m -65.61 -35.24 80.24 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.813 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.846 ' HA ' HD13 ' B' ' 42' ' ' ILE . . . -71.8 -30.28 65.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.74 ' HA ' HD12 ' B' ' 29' ' ' LEU . 34.3 m -72.68 -39.35 67.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.593 178.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.657 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -55.99 -45.34 79.02 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.237 178.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.649 ' O ' ' HD1' ' B' ' 32' ' ' TYR . . . -76.13 -22.17 55.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.042 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' B' ' 26' ' ' THR . 4.6 mt -75.46 -34.17 60.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.651 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -90.0 -25.12 21.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.931 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.782 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.8 mmtm -85.2 -27.62 26.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.531 179.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.782 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -151.81 163.39 39.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.464 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.431 ' CG ' ' O ' ' B' ' 33' ' ' ASN . 28.4 t-20 -128.39 39.25 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.085 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.965 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 18.2 mm -120.54 104.41 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.9 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.717 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 0.8 OUTLIER -29.64 -66.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.045 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.759 ' HG3' HG23 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -51.75 -50.43 60.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.791 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.965 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.6 OUTLIER -53.84 -61.99 1.94 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.905 0.383 . . . . 0.0 110.44 179.695 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.943 HG22 HD12 ' B' ' 42' ' ' ILE . 5.0 mt -44.46 -48.65 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.017 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.647 ' HB3' HG13 ' B' ' 58' ' ' VAL . . . -58.98 -43.63 91.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.152 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.723 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -55.58 -64.51 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.921 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.612 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -51.31 -57.17 9.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.943 HD12 HG22 ' B' ' 38' ' ' ILE . 87.8 mt -43.52 -62.67 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.667 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 4.6 tttt -53.93 -30.67 47.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.576 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' B' ' 41' ' ' HIS . 3.9 mttt -68.38 -48.55 64.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.207 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.466 ' O ' ' CB ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -68.11 -42.16 80.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.665 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.765 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -63.26 -33.39 75.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.892 -179.922 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.788 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.7 OUTLIER -71.11 -49.22 46.6 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.96 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -21.67 46.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.549 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.79 ' O ' ' HD3' ' B' ' 49' ' ' LYS . 0.4 OUTLIER -90.53 -30.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.609 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.546 ' HD2' ' HA ' ' B' ' 46' ' ' PHE . 87.4 m-85 -115.52 -64.48 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.75 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 1.2 t-20 158.94 114.37 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.183 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.788 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 85.1 Cg_exo -47.3 152.83 2.06 Favored 'Trans proline' 0 CA--C 1.533 0.426 0 C-N-CA 122.284 1.99 . . . . 0.0 112.659 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.727 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 8.9 t -122.82 126.0 46.54 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 122.921 0.488 . . . . 0.0 111.036 0.116 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.98 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 44.5 m95 -90.62 117.16 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.747 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.781 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -96.07 109.16 21.62 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.497 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.778 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 0.5 OUTLIER -123.52 149.91 44.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.354 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.914 HD11 ' HB2' ' A' ' 64' ' ' SER . 23.2 mm -130.76 109.79 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.73 ' HA ' ' O ' ' B' ' 82' ' ' ALA . 2.8 p -110.27 125.67 67.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.93 0.395 . . . . 0.0 111.232 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.782 ' O ' HG11 ' B' ' 81' ' ' VAL . . . -138.37 -128.28 2.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.965 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.744 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.6 OUTLIER -165.3 5.78 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.707 0.289 . . . . 0.0 111.613 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.744 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 2.0 t-20 164.32 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.81 0.338 . . . . 0.0 110.974 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.894 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -87.4 -171.15 3.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.043 0.449 . . . . 0.0 110.845 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.606 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -136.97 77.58 0.34 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.884 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 1.005 ' HB2' HD12 ' A' ' 57' ' ' ILE . 5.8 p -70.55 142.21 51.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.031 0.444 . . . . 0.0 111.23 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 1.03 ' HB2' ' HB2' ' A' ' 39' ' ' ALA . 48.8 t80 -146.04 76.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.356 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.835 HG11 ' HB3' ' A' ' 55' ' ' HIS . 4.4 m -125.02 131.08 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.272 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.781 HG23 HG22 ' A' ' 53' ' ' THR . 2.6 t -78.31 130.61 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.024 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.498 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.1 OUTLIER -72.65 177.45 4.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.564 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.7 OUTLIER -163.97 38.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.247 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.437 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 178.99 -113.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.134 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.534 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -158.63 25.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.792 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.978 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 17.1 m80 -124.58 44.82 2.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.84 ' HE1' HD13 ' B' ' 84' ' ' LEU . 8.1 t80 -124.33 90.51 3.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.545 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 1.043 HG13 ' HB3' ' B' ' 11' ' ' ALA . 0.8 OUTLIER -106.74 132.04 55.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.047 0.451 . . . . 0.0 111.508 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.853 ' HD1' HD12 ' B' ' 84' ' ' LEU . 18.3 t80 -119.78 134.04 55.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.818 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.948 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.1 OUTLIER -161.37 166.84 26.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.984 0.421 . . . . 0.0 111.16 -179.672 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.625 ' HH ' ' HA ' ' B' ' 80' ' ' GLN . 6.4 t80 -128.06 111.7 13.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.894 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 0.739 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.62 166.52 18.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.458 179.763 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.43 -60.85 0.1 Allowed Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.502 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.625 ' HA ' ' HH ' ' B' ' 77' ' ' TYR . 0.0 OUTLIER -132.81 36.15 3.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.288 179.36 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.782 HG11 ' O ' ' B' ' 59' ' ' GLY . 68.9 t -152.15 169.78 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.566 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.73 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -137.02 147.49 46.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.983 0.42 . . . . 0.0 110.998 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.749 HG22 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -133.26 131.7 58.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.074 -179.812 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.862 HD22 HG12 ' B' ' 57' ' ' ILE . 3.3 tp -123.83 83.73 2.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.701 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.734 HD12 ' CB ' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -87.45 131.85 34.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.007 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.796 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -160.98 125.6 3.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.98 ' HG3' ' HA ' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -105.54 143.75 33.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.737 179.879 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.781 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -91.47 19.47 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.251 0.548 . . . . 0.0 110.735 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . 0.625 ' O ' ' HE2' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.447 -1.196 . . . . 0.0 112.511 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.502 ' HA ' ' HD2' ' A' ' 5' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.985 0.422 . . . . 0.0 110.683 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.055 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.61 169.19 12.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.704 HG11 ' HE2' ' A' ' 9' ' ' LYS . 47.6 t -120.96 82.8 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.929 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -55.18 136.52 17.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.117 0.484 . . . . 0.0 110.639 -179.885 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.704 ' HE2' HG11 ' A' ' 7' ' ' VAL . 0.5 OUTLIER -125.19 -12.85 6.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.041 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.6 ' O ' ' N ' ' A' ' 75' ' ' TYR . 29.9 t30 -176.51 122.85 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.356 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.871 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -149.89 91.03 1.74 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.789 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -75.32 28.52 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.139 0.495 . . . . 0.0 109.841 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.874 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 2.0 ttm -114.14 163.28 15.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.77 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.771 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.2 OUTLIER -56.9 137.78 54.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.618 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.1 mp0 -41.76 -78.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.458 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 2.8 mm-40 -40.02 -27.29 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.779 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.822 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.4 -42.44 53.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.849 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.871 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -64.85 -32.86 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.894 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -76.28 -42.04 46.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.157 0.503 . . . . 0.0 109.717 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.699 ' HB3' ' HH ' ' A' ' 50' ' ' TYR . 5.3 m-20 -70.49 -30.73 67.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.669 179.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.806 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 21.9 t -66.84 -45.1 79.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.806 ' HA ' ' CZ ' ' A' ' 76' ' ' PHE . 46.8 t -59.98 -46.74 93.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.31 -40.74 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.071 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.795 ' HA ' ' HG3' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -66.23 -38.45 87.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.079 179.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.917 ' HB3' HG21 ' A' ' 83' ' ' ILE . . . -68.61 -26.93 65.61 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.531 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.3 m -73.84 -40.23 63.46 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.795 178.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.795 ' HG3' ' HA ' ' A' ' 24' ' ' CYS . 7.0 mt-30 -56.87 -44.34 82.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.75 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.717 ' CB ' HG22 ' A' ' 38' ' ' ILE . . . -79.45 -21.83 44.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.544 179.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.987 HD21 HG13 ' A' ' 81' ' ' VAL . 6.5 mt -73.25 -44.09 60.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.084 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -81.48 -29.64 33.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.075 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.493 ' CB ' ' CE1' ' A' ' 32' ' ' TYR . 2.4 mttm -77.77 -36.13 50.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.757 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.627 ' CD1' ' N ' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -150.33 151.8 33.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.815 179.693 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.509 ' HA ' ' CD1' ' A' ' 38' ' ' ILE . 1.6 m-80 -125.88 35.44 4.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.074 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.952 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 36.2 mm -98.44 32.09 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.099 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.619 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 4.1 mp0 41.24 -86.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.376 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.615 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.75 -50.98 5.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.307 179.26 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.952 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.9 OUTLIER -53.99 -54.24 41.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.323 179.368 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.717 HG22 ' CB ' ' A' ' 28' ' ' ALA . 4.7 mt -54.33 -59.08 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.829 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.765 ' N ' HG13 ' A' ' 58' ' ' VAL . . . -48.74 -40.38 28.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.779 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.805 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -54.66 -67.59 0.25 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.81 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.62 ' ND1' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -49.05 -45.72 43.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.76 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.835 HG21 HD12 ' A' ' 85' ' ' LEU . 58.7 mt -49.96 -48.8 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.969 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.631 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 8.4 tmtt? -66.81 -59.64 3.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.52 ' HZ3' ' HG2' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -40.04 -57.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.958 0.409 . . . . 0.0 110.971 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.678 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 1.6 tp10 -60.93 -38.25 85.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.263 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.806 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -69.19 -27.23 65.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.085 -179.651 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.81 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -90.3 -13.95 34.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 0.0 110.414 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.627 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -111.39 -8.8 14.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.611 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.718 ' HD2' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -106.56 -23.1 12.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.216 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.718 ' CE1' ' HD2' ' A' ' 49' ' ' LYS . 3.9 m-85 -123.94 -62.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.518 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.483 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 1.3 t30 156.19 121.98 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.973 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.81 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 31.4 Cg_endo -63.03 172.26 5.17 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.646 2.231 . . . . 0.0 112.686 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.553 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 36.0 m -102.08 133.72 46.47 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 122.819 0.448 . . . . 0.0 110.492 -0.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.764 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 56.0 m95 -104.23 140.23 38.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.286 0.565 . . . . 0.0 112.147 -179.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.874 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.6 OUTLIER -130.43 99.83 5.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.212 -0.903 . . . . 0.0 108.811 178.767 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.799 ' HB2' HD11 ' A' ' 85' ' ' LEU . 0.5 OUTLIER -116.89 167.81 10.79 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -177.648 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.888 HD13 ' HA ' ' B' ' 64' ' ' SER . 17.5 mm -135.14 156.49 39.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.789 178.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.786 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 10.0 p -158.9 109.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.935 0.397 . . . . 0.0 111.629 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.594 ' O ' HG11 ' A' ' 81' ' ' VAL . . . -139.44 -130.76 2.75 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.019 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.611 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -164.04 -28.9 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 120.737 0.303 . . . . 0.0 111.416 -179.678 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.437 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 53.0 t30 -152.88 45.98 0.69 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.964 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 1.021 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -103.0 -163.26 0.98 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.973 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.806 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.43 90.84 0.15 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.073 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.96 ' HA ' HG12 ' B' ' 57' ' ' ILE . 3.3 p -78.28 147.05 34.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.407 . . . . 0.0 111.22 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.817 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 13.2 t80 -154.6 62.61 0.67 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.645 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.796 HG22 HD23 ' A' ' 84' ' ' LEU . 4.5 m -124.59 140.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.324 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.748 HG21 ' CG2' ' B' ' 53' ' ' THR . 15.2 t -86.16 149.91 24.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.706 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.414 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -78.3 -157.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.96 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.1 OUTLIER -140.86 -51.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.761 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 t -141.01 -60.37 0.49 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.868 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.761 ' HG2' ' C ' ' A' ' 70' ' ' THR . 0.0 OUTLIER -157.03 -136.88 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.776 -179.933 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.861 ' HA ' ' HG3' ' A' ' 13' ' ' MET . 2.9 m-70 31.75 35.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.874 ' N ' ' HB2' ' A' ' 13' ' ' MET . 6.5 t80 -116.73 100.69 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.748 0.309 . . . . 0.0 110.735 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.901 HG22 ' HE1' ' A' ' 76' ' ' PHE . 2.4 tt -117.19 153.17 18.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.969 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 10' ' ' ASN . 10.0 t80 -149.83 93.23 2.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.66 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.929 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -113.78 -176.17 2.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.33 -179.51 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.607 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 31.1 t80 -143.0 91.03 2.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.811 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.055 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -49.4 174.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.927 -179.945 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.461 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.19 -59.95 0.26 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.577 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.439 HE21 ' HB3' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -133.57 34.05 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.753 0.311 . . . . 0.0 110.729 179.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.987 HG13 HD21 ' A' ' 29' ' ' LEU . 96.2 t -148.97 164.22 4.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.272 -179.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.855 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -129.95 153.18 48.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.59 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.917 HG21 ' HB3' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -144.5 118.49 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.373 . . . . 0.0 111.039 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.837 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 6.5 tp -107.48 86.55 2.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.835 HD12 HG21 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -87.75 138.69 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.466 -179.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.695 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -175.5 125.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.321 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.764 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 53.1 mtpt -82.12 -171.7 3.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.797 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.96 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 2.2 m . . . . . 0 C--N 1.327 -0.409 0 CA-C-O 121.305 0.574 . . . . 0.0 110.353 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.533 ' O ' HG11 ' B' ' 22' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.821 0.343 . . . . 0.0 110.973 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.743 ' O ' HD12 ' B' ' 78' ' ' LEU . 0.2 OUTLIER 59.78 108.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.032 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.21 -168.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.633 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.726 HG13 ' HE2' ' B' ' 9' ' ' LYS . 10.5 t -157.03 73.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.901 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.849 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -38.16 150.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.726 ' HE2' HG13 ' B' ' 7' ' ' VAL . 63.2 mmtt -146.9 -3.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.492 ' HA ' HD21 ' B' ' 10' ' ' ASN . 0.0 OUTLIER 179.02 83.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.147 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.849 ' HB3' ' NE2' ' B' ' 18' ' ' GLN . . . -109.63 72.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.794 -179.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.752 ' HB2' ' HD2' ' B' ' 73' ' ' PHE . 0.6 OUTLIER -73.52 33.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.752 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.932 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -129.56 172.05 11.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.716 -178.782 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.857 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.98 133.21 32.83 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.94 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.762 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 3.2 mp0 -51.64 -69.43 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.408 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -52.21 -29.83 24.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.517 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.794 ' HG2' ' CG ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -75.17 -32.79 61.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.968 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.849 ' NE2' ' HB3' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -76.06 -28.59 57.69 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.854 0.359 . . . . 0.0 110.352 179.271 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.492 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 5.2 mm100 -72.87 -40.29 65.76 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.527 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 8.7 m-20 -68.33 -30.59 69.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.17 178.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.801 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -62.97 -48.7 77.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.976 178.97 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.795 ' HA ' ' CZ ' ' B' ' 76' ' ' PHE . 95.5 t -55.25 -51.86 51.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.006 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 7.9 mt-10 -54.77 -36.34 64.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.862 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -36.18 70.41 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.704 ' HA ' HD12 ' B' ' 42' ' ' ILE . . . -70.65 -23.14 62.46 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.735 ' HA ' HD13 ' B' ' 29' ' ' LEU . 6.5 m -78.59 -42.2 29.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.599 178.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.769 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -54.04 -46.54 71.91 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.59 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.881 ' HB2' ' HA ' ' B' ' 38' ' ' ILE . . . -69.73 -36.77 76.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.005 178.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.735 HD13 ' HA ' ' B' ' 26' ' ' THR . 5.8 mt -58.27 -53.0 63.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.026 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.608 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.769 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 11.0 mmmt -75.99 -25.68 56.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.3 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.513 ' CG ' ' C ' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -171.92 133.51 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.868 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -92.76 26.58 2.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.043 0.449 . . . . 0.0 110.601 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.642 ' HB ' ' CB ' ' B' ' 37' ' ' ASP . 42.8 mm -96.39 103.57 14.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.688 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 1.004 ' HG3' ' HA2' ' B' ' 59' ' ' GLY . 0.2 OUTLIER -30.05 -70.46 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.535 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -48.15 -53.77 15.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.806 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.642 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 18.3 t0 -48.77 -62.17 1.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.63 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.881 ' HA ' ' HB2' ' B' ' 28' ' ' ALA . 16.6 mt -44.12 -50.78 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.047 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.813 ' HB2' HG11 ' B' ' 58' ' ' VAL . . . -54.58 -47.54 73.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.984 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.817 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -60.01 -50.83 72.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.626 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.8 ' CD2' ' HB1' ' B' ' 28' ' ' ALA . 1.0 OUTLIER -52.9 -50.63 63.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.718 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.704 HD12 ' HA ' ' B' ' 25' ' ' ALA . 19.2 mt -59.97 -70.5 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.641 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.707 ' HD2' ' CE2' ' A' ' 65' ' ' TYR . 0.6 OUTLIER -38.54 -33.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.93 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.431 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 18.2 tttp -68.92 -60.45 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.034 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.743 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 3.0 mm-40 -62.29 -24.8 67.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.881 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.801 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -76.73 -38.81 53.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.605 179.759 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.629 ' HB2' ' HD3' ' B' ' 52' ' ' PRO . 0.6 OUTLIER -66.11 -35.59 80.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.714 179.791 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.468 ' HB3' ' HE2' ' B' ' 48' ' ' LYS . 3.0 mmmm -88.6 -32.51 18.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.743 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -76.35 -25.44 54.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.894 179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.769 ' CD1' ' HE2' ' B' ' 17' ' ' MET . 26.0 m-85 -130.45 -68.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.718 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 1.4 t30 155.02 119.2 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.188 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.629 ' HD3' ' HB2' ' B' ' 47' ' ' ASP . 20.7 Cg_endo -60.4 175.73 1.03 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.326 2.018 . . . . 0.0 112.346 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.795 ' O ' ' HB3' ' B' ' 87' ' ' LYS . 2.0 m -100.51 131.44 46.43 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.951 0.5 . . . . 0.0 110.547 0.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.806 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 64.6 m95 -103.14 100.86 10.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.007 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.751 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 20.5 m170 -73.45 94.37 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.761 ' HB2' HD11 ' B' ' 85' ' ' LEU . 0.5 OUTLIER -111.22 154.28 24.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.276 0.56 . . . . 0.0 112.148 -177.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.978 ' HB ' HD21 ' B' ' 84' ' ' LEU . 29.9 mt -151.15 110.84 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.71 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.813 HG11 ' HB2' ' B' ' 39' ' ' ALA . 1.4 p -107.03 131.61 56.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.187 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 1.004 ' HA2' ' HG3' ' B' ' 35' ' ' GLU . . . -149.46 -134.06 2.28 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.842 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.438 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 1.5 ptm180 -161.51 1.66 0.06 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 120.704 0.288 . . . . 0.0 111.105 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 1.2 t-20 174.55 34.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.162 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 1.021 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 54.8 p90 -90.48 174.48 7.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 0.0 110.76 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.619 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -123.02 74.17 0.39 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.035 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.888 ' HA ' HD13 ' A' ' 57' ' ' ILE . 28.4 p -74.35 102.76 4.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.879 0.371 . . . . 0.0 111.087 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.805 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 12.7 t80 -109.47 67.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.939 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.874 HG12 HD12 ' A' ' 57' ' ' ILE . 18.6 m -101.14 165.65 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.026 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.772 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 2.3 m -115.15 95.52 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.973 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.629 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.0 OUTLIER -54.17 175.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.885 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.641 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.4 OUTLIER -168.76 80.02 0.14 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.977 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.58 ' O ' ' HG2' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 163.62 -97.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.901 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.7 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -175.72 16.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.552 179.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.932 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 93.5 m-70 -126.93 69.47 1.27 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.854 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.0 t80 -128.83 75.33 1.63 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.507 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.832 HD12 ' HB2' ' B' ' 18' ' ' GLN . 1.2 tt -91.23 129.38 42.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.376 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.675 ' CD1' ' HB2' ' B' ' 84' ' ' LEU . 17.1 t80 -128.29 87.45 2.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.489 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.849 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 4.8 p90 -109.7 164.27 12.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.24 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.627 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 53.8 t80 -123.38 114.79 20.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.71 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.032 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.57 166.14 19.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.823 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.483 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -30.81 -36.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.66 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -151.33 30.73 0.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.914 0.388 . . . . 0.0 110.777 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.747 HG13 ' O ' ' B' ' 59' ' ' GLY . 42.5 t -146.0 168.84 6.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.915 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.627 ' HA ' ' HA ' ' B' ' 77' ' ' TYR . . . -137.34 109.22 7.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.322 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.707 HG12 HD22 ' B' ' 78' ' ' LEU . 0.9 OUTLIER -101.25 133.78 43.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.239 0.542 . . . . 0.0 112.068 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.978 HD21 ' HB ' ' B' ' 57' ' ' ILE . 0.1 OUTLIER -119.28 132.27 55.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.873 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.789 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 3.2 mp -137.35 101.5 4.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.854 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 12.5 p90 -139.61 123.87 17.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.97 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.795 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -91.8 159.18 15.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.641 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 1.3 m -117.64 19.95 13.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.31 0.576 . . . . 0.0 110.246 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.55 -179.891 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.767 ' O ' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.846 0.355 . . . . 0.0 111.166 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.042 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -139.09 170.43 15.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.753 HG11 ' HE2' ' A' ' 9' ' ' LYS . 26.3 t -131.15 85.81 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.043 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.844 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -49.32 156.54 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.193 0.521 . . . . 0.0 110.826 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.753 ' HE2' HG11 ' A' ' 7' ' ' VAL . 1.2 mmtp -144.78 -14.93 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.935 179.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.77 77.97 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.396 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.892 ' HB3' HG13 ' A' ' 74' ' ' ILE . . . -101.78 76.33 1.63 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.673 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.497 ' OD2' ' CD2' ' A' ' 68' ' ' HIS . 59.3 t0 -77.93 30.25 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.132 0.491 . . . . 0.0 109.973 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.902 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.4 OUTLIER -121.91 163.34 19.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 -179.481 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.841 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -50.13 128.43 19.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.976 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.744 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.3 mm-40 -37.83 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.022 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.793 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.9 OUTLIER -44.33 -31.1 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.902 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -70.94 -37.01 72.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.249 179.535 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.879 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -68.54 -30.29 69.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.475 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.793 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -76.77 -38.3 54.34 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.44 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.4 -25.75 62.47 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.655 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.802 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -72.96 -50.66 22.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.106 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.76 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 17.2 t -60.15 -38.27 76.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.528 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.717 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 47.5 mt-10 -67.15 -38.66 85.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.897 179.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.5 m -70.18 -34.77 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.606 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.846 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -72.52 -36.38 68.31 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.975 ' HA ' HD12 ' A' ' 29' ' ' LEU . 52.0 m -69.05 -36.5 77.75 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.565 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -61.5 -39.35 90.65 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.479 178.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.99 ' HB3' HG21 ' A' ' 38' ' ' ILE . . . -71.92 -28.75 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.604 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.975 HD12 ' HA ' ' A' ' 26' ' ' THR . 1.2 mt -72.7 -41.39 65.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.81 -32.75 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.152 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.432 ' HB3' ' CE2' ' A' ' 32' ' ' TYR . 1.2 mtpp -86.71 -26.59 24.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.043 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.601 ' HE1' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.18 178.18 10.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.746 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.594 ' HA ' HD11 ' A' ' 38' ' ' ILE . 0.4 OUTLIER -158.39 40.19 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.02 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 1.013 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 42.0 mm -103.61 39.28 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HB3' ' C ' ' B' ' 62' ' ' PHE . 4.5 mp0 43.33 -86.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.252 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.694 ' HZ3' ' HH ' ' B' ' 75' ' ' TYR . 2.9 mtpt -48.82 -33.36 10.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.874 0.369 . . . . 0.0 110.228 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 1.013 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -65.88 -45.66 81.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.264 179.472 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.99 HG21 ' HB3' ' A' ' 28' ' ' ALA . 2.8 mp -65.1 -38.4 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.473 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 1.023 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -61.53 -43.13 99.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.424 179.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.66 ' HB3' ' CE1' ' B' ' 65' ' ' TYR . . . -62.38 -55.76 24.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.284 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.746 ' CD2' ' HB1' ' A' ' 28' ' ' ALA . 0.7 OUTLIER -47.81 -47.08 31.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.461 179.328 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.846 HG12 ' HA ' ' A' ' 25' ' ' ALA . 14.1 mt -67.18 -69.25 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.138 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.612 ' HG3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -43.42 -35.27 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.056 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -66.21 -62.19 1.62 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.821 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.653 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 13.5 mt-10 -52.98 -51.24 62.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.802 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -53.12 -52.14 59.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.787 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -57.43 -27.03 62.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.027 -179.876 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 48' ' ' LYS . 24.1 mmmt -113.94 9.61 17.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.147 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.653 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -121.73 -5.12 9.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.111 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.604 ' CD1' ' HA ' ' A' ' 46' ' ' PHE . 11.5 m-85 -148.56 -61.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.307 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.538 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 1.2 p-10 161.45 117.08 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.445 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.787 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 33.2 Cg_endo -64.23 167.21 15.0 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.449 2.099 . . . . 0.0 112.568 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.745 ' CG2' HG22 ' B' ' 67' ' ' THR . 4.9 t -109.54 122.28 47.07 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.757 0.423 . . . . 0.0 110.773 -0.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.695 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 28.4 m95 -89.7 135.86 33.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.841 -179.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.715 ' HB2' ' CD1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -102.21 104.84 15.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.161 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.798 ' HB3' HD12 ' A' ' 85' ' ' LEU . 1.6 m -113.11 125.14 54.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.121 0.486 . . . . 0.0 112.171 -178.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.788 ' HB ' HD21 ' A' ' 84' ' ' LEU . 13.4 mt -126.42 99.73 5.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.781 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.833 HG12 ' HB ' ' A' ' 38' ' ' ILE . 3.3 p -99.63 123.54 52.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.996 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.73 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -146.0 -150.69 5.25 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.171 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.744 ' HG3' HH11 ' A' ' 60' ' ' ARG . 0.0 OUTLIER -158.28 13.5 0.19 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.682 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 35.1 t30 174.08 35.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.449 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.923 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -100.06 157.78 16.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.152 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.892 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -114.73 83.75 0.34 Allowed Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.955 ' HA ' HD11 ' B' ' 57' ' ' ILE . 84.5 p -79.78 137.94 37.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.1 0.476 . . . . 0.0 111.75 -178.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 1.003 ' HB2' ' HB2' ' B' ' 39' ' ' ALA . 1.5 t80 -141.35 58.09 1.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.263 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.801 ' HA ' ' HB3' ' B' ' 55' ' ' HIS . 27.5 m -104.94 129.63 57.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.039 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.457 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 5.2 m -81.7 123.76 29.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.54 ' H ' ' HD1' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -71.79 172.92 8.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.613 179.743 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.477 ' O ' ' HB ' ' A' ' 70' ' ' THR . 7.3 pt-20 -169.74 75.09 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.066 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.767 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 1.5 t 165.58 -104.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 70' ' ' THR . 17.3 mtmt -171.91 18.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.814 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.737 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 66.5 m-70 -130.56 67.47 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.707 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.674 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 1.8 t80 -133.16 93.42 3.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.597 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.892 HG13 ' HB3' ' A' ' 11' ' ' ALA . 3.2 tt -108.96 122.69 64.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.323 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.753 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 34.9 t80 -116.11 88.51 2.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.453 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.844 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -113.3 168.85 9.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.934 0.397 . . . . 0.0 111.411 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.681 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 10.0 t80 -130.09 100.51 5.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.725 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.042 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.1 mm? -53.95 172.15 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -36.09 -36.57 0.14 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.689 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.635 ' O ' HG23 ' A' ' 81' ' ' VAL . 6.7 tp60 -151.5 41.23 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.915 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 1.017 HG12 HD11 ' A' ' 83' ' ' ILE . 42.1 t -158.6 166.54 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.014 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.681 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -134.33 110.12 9.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 1.017 HD11 HG12 ' A' ' 81' ' ' VAL . 0.3 OUTLIER -99.71 118.1 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.038 0.447 . . . . 0.0 111.597 -179.28 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.788 HD21 ' HB ' ' A' ' 57' ' ' ILE . 1.6 tp -102.74 90.68 3.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.111 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.798 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.6 OUTLIER -99.23 124.62 44.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.478 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.727 ' HZ ' ' HZ ' ' B' ' 86' ' ' PHE . 1.3 p90 -168.57 132.72 1.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.209 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.661 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -92.94 168.2 11.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.847 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.61 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 121.168 0.509 . . . . 0.0 110.826 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.51 ' H ' ' HG2' ' B' ' 4' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.812 0.339 . . . . 0.0 110.505 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.656 ' HE3' ' H ' ' B' ' 6' ' ' ALA . 0.0 OUTLIER 57.42 -168.04 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.34 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.101 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 57.94 -178.34 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.514 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.773 ' O ' ' HD2' ' B' ' 9' ' ' LYS . 80.3 t -147.78 75.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.776 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.891 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -44.28 153.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.008 0.432 . . . . 0.0 110.211 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.773 ' HD2' ' O ' ' B' ' 7' ' ' VAL . 0.0 OUTLIER -135.29 -22.92 1.51 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.242 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.549 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 2.2 t-20 -145.74 -104.66 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.998 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.956 ' HB1' ' HA ' ' B' ' 74' ' ' ILE . . . 76.19 129.64 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.08 0.467 . . . . 0.0 112.091 178.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.688 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -124.49 35.22 4.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.169 179.094 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.655 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 23.0 ttp -121.28 158.2 28.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.962 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.717 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -38.87 158.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 179.747 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.684 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 13.1 mt-10 -67.17 -57.39 6.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.011 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.524 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.1 OUTLIER -55.75 -24.82 37.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.658 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.655 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -78.35 -43.53 27.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.717 ' HG2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -60.75 -37.79 82.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.923 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.74 -42.21 58.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.181 0.515 . . . . 0.0 109.907 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.645 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -65.19 -31.87 73.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.904 179.1 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.745 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 1.0 OUTLIER -66.01 -49.4 67.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.978 179.172 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.769 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 92.5 t -53.28 -46.52 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.672 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.543 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 5.0 mm-40 -61.94 -35.81 79.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.416 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.48 -32.43 69.95 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.794 ' HA ' HG12 ' B' ' 42' ' ' ILE . . . -71.99 -40.59 68.45 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.935 ' HA ' HD13 ' B' ' 29' ' ' LEU . 85.2 m -64.94 -42.51 94.58 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.876 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 23.5 mt-30 -55.1 -46.84 75.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.853 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.765 ' HB2' ' HA ' ' B' ' 38' ' ' ILE . . . -63.45 -32.62 74.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.38 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.935 HD13 ' HA ' ' B' ' 26' ' ' THR . 1.0 OUTLIER -68.51 -51.39 43.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.186 -179.778 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -33.25 71.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.969 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.404 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 13.1 mttt -82.88 -35.09 26.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.77 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.487 ' HE2' ' HB2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -146.64 150.87 36.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.737 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -114.97 32.05 6.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.007 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.95 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.1 mm -114.93 110.97 33.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.82 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.892 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 3.4 mp0 -29.99 -70.79 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.24 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.739 ' HE3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -46.23 -48.25 17.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.738 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.95 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -56.9 -62.16 1.94 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.631 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.774 ' HB ' HG11 ' B' ' 58' ' ' VAL . 4.2 mt -45.82 -45.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 1.003 ' HB2' ' HB2' ' A' ' 65' ' ' TYR . . . -59.35 -55.33 36.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.713 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.787 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -51.02 -45.07 61.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.667 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.756 ' CD2' ' HB1' ' B' ' 28' ' ' ALA . 1.5 t60 -59.1 -50.95 72.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.794 HG12 ' HA ' ' B' ' 25' ' ' ALA . 26.0 mt -60.71 -70.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.288 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.665 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 1.5 ttpt -37.19 -57.14 0.89 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.54 -44.67 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.087 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.548 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.2 OUTLIER -63.8 -33.72 76.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.759 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.745 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -74.67 -36.38 62.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.702 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.778 ' OD2' ' HB3' ' B' ' 52' ' ' PRO . 0.2 OUTLIER -68.82 -35.71 77.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.953 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.463 ' HE3' ' HB3' ' B' ' 48' ' ' LYS . 17.6 mmmt -90.75 -38.76 12.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.774 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.0 OUTLIER -77.79 -22.42 50.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.887 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.777 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 77.7 m-85 -120.61 -71.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.777 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.5 t-20 158.54 118.68 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.778 ' HB3' ' OD2' ' B' ' 47' ' ' ASP . 10.6 Cg_endo -53.3 167.21 0.86 Allowed 'Trans proline' 0 CA--C 1.534 0.484 0 C-N-CA 122.438 2.092 . . . . 0.0 112.791 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.585 HG21 ' NE2' ' B' ' 55' ' ' HIS . 16.3 m -104.68 131.37 52.19 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.774 0.43 . . . . 0.0 110.55 0.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.773 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 60.4 m95 -105.81 139.36 40.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.358 0.599 . . . . 0.0 111.884 -179.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.825 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.1 98.76 4.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.642 178.662 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.765 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 0.4 OUTLIER -119.87 162.03 19.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.453 0.644 . . . . 0.0 112.485 -177.795 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.955 HD11 ' HA ' ' A' ' 64' ' ' SER . 20.0 mm -127.94 162.31 34.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.43 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.774 HG11 ' HB ' ' B' ' 38' ' ' ILE . 4.9 p -160.24 102.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.833 0.349 . . . . 0.0 111.331 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.701 ' O ' HG12 ' B' ' 81' ' ' VAL . . . -136.73 -123.72 2.27 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.102 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -174.61 -46.15 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.787 0.327 . . . . 0.0 111.2 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m-20 -132.25 52.99 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.235 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.923 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -113.84 -154.08 0.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.909 0.385 . . . . 0.0 110.642 179.792 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.722 ' O ' ' HA ' ' A' ' 57' ' ' ILE . . . -154.53 103.84 0.24 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.676 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.733 ' HA ' HG12 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -96.2 137.9 34.6 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.121 0.486 . . . . 0.0 111.486 -179.205 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 1.023 ' HB2' ' HB3' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -143.83 51.71 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.157 179.6 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.681 ' CB ' ' HB3' ' A' ' 55' ' ' HIS . 4.5 m -99.6 139.9 20.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.44 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.745 HG22 ' CG2' ' A' ' 53' ' ' THR . 2.3 t -76.69 138.4 39.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.483 ' CD2' ' CB ' ' B' ' 12' ' ' ASP . 13.9 p-80 -110.81 159.04 18.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.58 176.71 12.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.657 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.652 ' C ' ' HG2' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 66.42 -92.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.976 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.652 ' HG2' ' C ' ' B' ' 70' ' ' THR . 0.9 OUTLIER 164.97 43.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.934 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.544 ' CG ' ' HD3' ' B' ' 87' ' ' LYS . 89.3 m-70 -134.32 46.86 2.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.717 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.692 ' HD2' ' HB3' ' B' ' 86' ' ' PHE . 1.0 OUTLIER -126.94 139.93 52.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.525 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.956 ' HA ' ' HB1' ' B' ' 11' ' ' ALA . 0.5 OUTLIER -149.64 129.32 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.956 0.408 . . . . 0.0 111.595 179.819 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.694 ' HH ' ' HZ3' ' A' ' 36' ' ' LYS . 8.5 t80 -114.2 133.54 55.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.986 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.891 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.2 OUTLIER -165.23 170.02 15.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.344 -179.506 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.681 ' OH ' ' HA ' ' B' ' 80' ' ' GLN . 5.8 t80 -132.67 116.7 16.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.042 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.101 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 3.7 mm? -69.91 167.04 18.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' B' ' 80' ' ' GLN . . . -28.3 -37.23 0.01 OUTLIER Glycine 0 CA--C 1.519 0.296 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.949 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.681 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 5.3 mt-30 -154.42 38.8 0.44 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.727 0.299 . . . . 0.0 111.08 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.798 HG13 ' N ' ' B' ' 82' ' ' ALA . 53.2 t -158.32 167.9 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.111 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.798 ' N ' HG13 ' B' ' 81' ' ' VAL . . . -124.36 160.45 28.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.662 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.753 HG13 ' CE2' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -147.5 131.6 9.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 0.0 111.409 -179.583 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.851 ' HB3' ' HB ' ' B' ' 57' ' ' ILE . 4.0 tp -122.73 90.92 3.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.818 ' HB2' HG22 ' B' ' 74' ' ' ILE . 0.9 OUTLIER -92.89 140.92 28.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.051 0.453 . . . . 0.0 111.682 -179.216 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.795 ' CE2' HG12 ' A' ' 66' ' ' VAL . 1.4 p90 -177.09 131.86 0.18 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.749 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.773 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.8 OUTLIER -96.73 158.65 15.33 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.56 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.825 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -103.17 19.22 19.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.235 0.54 . . . . 0.0 110.511 179.799 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.424 -179.986 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.568 ' O ' HD12 ' A' ' 78' ' ' LEU . 15.3 tppt? . . . . . 0 C--O 1.23 0.045 0 CA-C-O 120.645 0.26 . . . . 0.0 110.936 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.011 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 156.21 156.95 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.719 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.525 HG12 ' HE2' ' A' ' 9' ' ' LYS . 58.0 t -123.38 78.85 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.006 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.876 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -48.85 164.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.171 0.51 . . . . 0.0 110.636 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.784 ' N ' HG22 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -163.16 -13.47 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.975 179.733 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.572 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -164.52 89.12 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.32 179.863 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.904 ' HB2' HG13 ' A' ' 74' ' ' ILE . . . -126.03 93.43 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.715 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 73' ' ' PHE . 9.1 t70 -85.15 28.98 0.68 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.906 179.007 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.748 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 34.6 ttp -120.28 157.67 28.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.983 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.793 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 2.3 m -41.32 147.36 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.556 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.9 OUTLIER -54.89 -56.29 21.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.248 -179.69 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.907 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.2 OUTLIER -62.29 -27.59 69.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.944 0.402 . . . . 0.0 110.251 179.78 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.755 ' HA ' ' OD2' ' A' ' 20' ' ' ASP . 39.7 mmm -71.29 -30.82 66.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.498 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.835 ' HA ' HD11 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -79.25 -29.03 42.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.212 179.327 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.907 ' HG2' ' HA ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -77.53 -43.95 30.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.652 179.165 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.755 ' OD2' ' HA ' ' A' ' 17' ' ' MET . 4.9 p30 -70.86 -31.05 67.62 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.492 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.756 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.3 t -65.14 -46.26 81.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.041 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.734 HG12 ' HB2' ' A' ' 6' ' ' ALA . 53.0 t -59.51 -46.87 92.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.088 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.698 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 28.7 mt-10 -56.46 -34.25 66.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.863 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.627 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 49.8 t -71.46 -36.53 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.076 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.772 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -71.78 -30.78 65.91 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.481 ' HA ' HD13 ' A' ' 29' ' ' LEU . 27.8 m -71.92 -37.99 69.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.252 -1.34 . . . . 0.0 109.429 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.802 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -59.69 -44.41 93.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.608 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.943 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -71.91 -25.61 61.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.838 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.905 HD12 ' HG ' ' A' ' 78' ' ' LEU . 3.0 mt -72.82 -45.73 56.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.148 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -77.83 -21.88 50.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.802 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 23.9 mmtt -90.04 -26.47 20.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.084 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.451 ' CG ' ' C ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -166.98 115.22 0.83 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.949 -179.844 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.47 ' OD1' ' O ' ' A' ' 29' ' ' LEU . 28.9 m-20 -81.54 32.79 0.35 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.087 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.804 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 39.7 mm -102.62 101.68 12.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.101 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.523 ' O ' HG11 ' A' ' 58' ' ' VAL . 1.8 mp0 -24.15 -86.96 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.444 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -40.03 -37.11 0.55 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.754 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.804 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -63.15 -62.19 1.87 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.645 179.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.954 HG23 HD11 ' A' ' 42' ' ' ILE . 20.8 mt -47.34 -44.22 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.661 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.8 ' N ' HG13 ' A' ' 58' ' ' VAL . . . -58.22 -46.98 84.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.483 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.801 ' HB2' ' CE1' ' B' ' 65' ' ' TYR . . . -57.97 -61.09 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.325 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.767 ' CD2' ' HB3' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -40.98 -58.6 1.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.607 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.954 HD11 HG23 ' A' ' 38' ' ' ILE . 6.1 mt -52.22 -70.94 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.735 ' HD2' ' C ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -38.17 -54.84 1.35 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.031 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.31 -62.74 1.28 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.042 0.448 . . . . 0.0 110.963 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.742 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -52.11 -50.7 61.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.152 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.756 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -57.81 -35.67 71.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.766 ' HA ' ' HD1' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -74.13 -21.16 59.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.39 13.38 10.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.331 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.742 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -129.37 6.35 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.39 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CD2' ' CD1' ' A' ' 46' ' ' PHE . 97.2 m-85 -148.61 -65.65 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 0.0 111.225 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.453 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 2.6 t-20 163.34 102.83 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.757 ' HA ' ' OD1' ' A' ' 47' ' ' ASP . 45.8 Cg_exo -36.87 154.49 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.665 2.243 . . . . 0.0 112.711 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.809 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 25.9 m -114.44 140.86 48.36 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.047 0.539 . . . . 0.0 110.369 -0.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.766 ' HD1' ' HA ' ' A' ' 47' ' ' ASP . 76.9 m95 -105.62 145.09 31.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.527 0.68 . . . . 0.0 112.422 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.899 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 4.5 m-70 -136.18 101.66 4.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.819 179.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.765 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.76 165.74 14.15 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.796 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 1.005 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 17.8 mm -133.86 169.66 21.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.22 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.8 HG13 ' N ' ' A' ' 39' ' ' ALA . 5.0 p -166.13 117.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.78 0.324 . . . . 0.0 111.475 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.554 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -151.08 -154.41 6.52 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.06 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.745 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -157.54 32.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.759 0.314 . . . . 0.0 111.388 -179.757 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.745 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER 163.94 29.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.74 179.851 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.82 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.0 OUTLIER -106.6 172.89 6.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.312 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.82 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.2 94.51 0.43 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.945 ' HA ' HD11 ' B' ' 57' ' ' ILE . 69.6 p -82.01 123.61 29.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 111.693 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.832 ' HB2' ' HB3' ' B' ' 39' ' ' ALA . 5.0 t80 -135.11 64.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.16 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.76 ' CB ' ' HB3' ' B' ' 55' ' ' HIS . 26.7 m -101.75 148.11 7.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.145 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.658 ' CB ' HG23 ' B' ' 53' ' ' THR . 5.4 m -91.14 76.05 6.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.509 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 50.8 p-80 -55.1 169.69 0.23 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.463 ' C ' ' OG1' ' A' ' 70' ' ' THR . 0.5 OUTLIER -151.73 169.4 22.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.864 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.517 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER 78.18 -101.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.052 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.665 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 179.03 28.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 1.074 ' HB2' ' HG3' ' A' ' 87' ' ' LYS . 32.6 m-70 -126.95 52.78 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.891 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 2.9 t80 -126.29 114.99 19.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.157 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.904 HG13 ' HB2' ' A' ' 11' ' ' ALA . 1.3 tt -126.4 137.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.895 0.379 . . . . 0.0 111.555 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.572 ' N ' ' O ' ' A' ' 10' ' ' ASN . 38.4 t80 -126.65 116.39 20.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.213 179.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.876 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -139.02 163.29 32.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.004 0.431 . . . . 0.0 111.456 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.624 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 25.8 t80 -121.17 93.41 4.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.499 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.011 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.3 mm? -43.78 172.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.645 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.488 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.82 -39.61 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.584 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.532 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -153.52 21.55 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.956 0.408 . . . . 0.0 110.767 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.848 HG13 ' H ' ' A' ' 82' ' ' ALA . 28.5 t -134.91 177.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.898 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.848 ' H ' HG13 ' A' ' 81' ' ' VAL . . . -137.95 153.33 49.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.805 0.336 . . . . 0.0 110.857 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.734 HG23 ' O ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -143.49 120.91 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.254 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 1.005 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 13.2 tp -104.6 90.51 3.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.482 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.875 HD13 HG23 ' A' ' 42' ' ' ILE . 0.3 OUTLIER -95.47 141.92 28.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.648 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.891 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 47.0 p90 177.48 138.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.698 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 1.074 ' HG3' ' HB2' ' A' ' 72' ' ' HIS . 8.0 mtmt -97.44 174.11 6.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.66 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.899 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-O 121.309 0.576 . . . . 0.0 110.534 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.644 ' NH1' ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.744 0.307 . . . . 0.0 110.72 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.593 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 49.61 30.46 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.07 179.93 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.026 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -124.99 -166.89 1.59 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.145 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.688 HG23 ' O ' ' B' ' 6' ' ' ALA . 57.8 t -151.18 73.84 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.957 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.959 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -41.04 159.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.093 0.473 . . . . 0.0 110.826 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.767 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 0.2 OUTLIER -155.04 -10.57 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.511 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.573 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.0 OUTLIER -164.6 84.79 0.42 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.34 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.92 ' HB3' HG13 ' B' ' 74' ' ' ILE . . . -123.53 88.99 3.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.881 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.609 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 10.8 t0 -87.6 25.35 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.26 0.552 . . . . 0.0 109.959 179.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.893 ' HG2' ' N ' ' B' ' 14' ' ' SER . 0.1 OUTLIER -110.96 166.84 10.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.656 -179.723 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.893 ' N ' ' HG2' ' B' ' 13' ' ' MET . 23.2 t -50.07 120.34 4.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.769 0.319 . . . . 0.0 110.731 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.863 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 3.2 mp0 -32.95 -67.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.178 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -46.93 -44.99 20.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.674 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.877 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 31.7 mmm -61.23 -32.08 71.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.863 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -68.35 -43.16 78.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.878 179.87 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.476 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 2.9 mp0 -69.36 -33.87 73.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -71.4 -33.26 69.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.966 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.802 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.6 OUTLIER -67.94 -40.74 83.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.22 179.435 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.798 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 10.7 t -62.97 -46.12 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.376 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.552 ' HG2' ' H ' ' B' ' 4' ' ' ARG . 29.8 mt-10 -62.58 -32.33 73.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.894 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.428 ' SG ' ' HD1' ' B' ' 46' ' ' PHE . 4.9 t -73.45 -36.44 65.9 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.908 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.904 ' HA ' HG12 ' B' ' 42' ' ' ILE . . . -69.27 -36.54 77.21 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.976 ' HA ' HD13 ' B' ' 29' ' ' LEU . 87.5 m -64.76 -42.79 94.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.618 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.621 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 12.8 mm100 -52.63 -48.67 66.22 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.803 179.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.742 ' HB1' ' HB3' ' B' ' 41' ' ' HIS . . . -59.83 -43.83 94.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.359 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.976 HD13 ' HA ' ' B' ' 26' ' ' THR . 0.9 OUTLIER -59.56 -60.57 3.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.806 179.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -48.57 -33.74 10.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.995 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.621 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 0.0 OUTLIER -85.28 -27.73 25.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.39 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.57 ' HE2' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -155.12 150.82 27.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.831 0.348 . . . . 0.0 111.226 -179.202 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.486 ' O ' HD11 ' B' ' 34' ' ' ILE . 35.6 t30 -115.36 47.07 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.95 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.856 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 42.0 mm -126.08 108.56 19.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.864 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.82 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 26.7 mp0 -29.53 -70.85 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.133 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.421 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -51.23 -49.11 61.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.766 0.317 . . . . 0.0 110.741 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.856 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.8 t0 -53.22 -64.27 0.87 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.862 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.732 ' CG2' ' HB2' ' B' ' 28' ' ' ALA . 11.6 mt -48.9 -43.74 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.691 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.832 ' HB3' ' HB2' ' A' ' 65' ' ' TYR . . . -55.32 -46.71 76.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.468 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.784 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -61.42 -67.27 0.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.496 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.742 ' HB3' ' HB1' ' B' ' 28' ' ' ALA . 0.7 OUTLIER -34.15 -40.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.538 179.44 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 1.058 HG21 HD11 ' B' ' 85' ' ' LEU . 33.9 mt -67.33 -50.91 58.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.298 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.699 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 6.1 tttt -55.33 -46.88 76.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.174 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -67.24 -36.83 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.209 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.609 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 8.5 mm-40 -68.45 -44.8 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.905 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.802 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -67.37 -35.27 79.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.678 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.866 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -66.79 -38.77 87.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.221 179.763 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.982 ' HA ' ' HE3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.66 -18.21 25.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.111 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.609 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.75 -29.58 19.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.383 -179.573 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.625 ' HE2' ' CD1' ' B' ' 46' ' ' PHE . 7.0 m-85 -131.74 -57.16 0.99 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.533 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.588 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 27.4 t-20 157.23 119.36 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.11 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.418 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.866 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 20.3 Cg_endo -59.77 170.72 3.31 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.558 2.172 . . . . 0.0 112.255 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.732 ' O ' ' HB3' ' B' ' 87' ' ' LYS . 4.4 m -106.85 129.47 54.69 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 123.154 0.582 . . . . 0.0 110.475 0.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.699 ' O ' ' HG3' ' B' ' 43' ' ' LYS . 58.0 m95 -101.74 116.81 33.54 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.835 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.0 OUTLIER -93.69 100.14 12.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.286 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.689 ' HB2' ' CD1' ' B' ' 85' ' ' LEU . 0.0 OUTLIER -108.54 148.62 30.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.305 0.574 . . . . 0.0 112.457 -178.005 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.945 HD11 ' HA ' ' A' ' 64' ' ' SER . 19.5 mm -133.6 103.7 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.376 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.813 HG11 ' HB1' ' B' ' 39' ' ' ALA . 2.4 p -105.87 117.78 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.398 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.765 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -132.43 -104.88 0.94 Allowed Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.177 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.563 ' HD3' ' CG ' ' A' ' 61' ' ' ASN . 1.0 OUTLIER 179.67 -17.71 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.777 0.323 . . . . 0.0 111.131 -179.778 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.469 ' CG ' ' O ' ' B' ' 60' ' ' ARG . 1.2 m120 177.78 41.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.82 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 27.6 p90 -87.61 -167.71 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -131.41 86.6 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.19 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.817 ' HB3' ' HE2' ' B' ' 62' ' ' PHE . 5.5 p -83.3 119.01 24.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 0.0 111.315 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.801 ' CE1' ' HB2' ' A' ' 40' ' ' ALA . 22.9 t80 -127.28 73.35 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.367 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.782 HG21 ' CE1' ' B' ' 86' ' ' PHE . 21.1 m -125.15 156.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.404 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.774 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 20.7 m -84.99 145.99 27.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.756 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.714 ' H ' ' ND1' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -97.5 173.44 7.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.925 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.707 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 1.3 mm-40 -138.59 -114.92 0.15 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.12 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.62 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -47.29 -103.45 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.066 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.657 ' O ' ' HB2' ' B' ' 72' ' ' HIS . 1.3 mmtt -55.45 0.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.771 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 0.7 OUTLIER 76.77 -89.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.622 -179.859 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.771 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 3.8 p90 163.46 155.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.986 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.92 HG13 ' HB3' ' B' ' 11' ' ' ALA . 1.1 tt -129.6 130.65 67.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.204 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.679 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -113.57 132.32 55.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.056 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.959 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.4 OUTLIER -158.21 152.54 24.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.966 0.412 . . . . 0.0 111.373 -179.45 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 1.0 OUTLIER -119.74 112.02 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.759 179.7 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.026 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -71.11 170.61 12.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.598 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.507 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.19 -55.93 0.06 OUTLIER Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.94 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.721 ' O ' HG22 ' B' ' 81' ' ' VAL . 0.2 OUTLIER -139.54 35.89 2.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.797 0.332 . . . . 0.0 111.035 179.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.835 HG13 ' N ' ' B' ' 82' ' ' ALA . 92.2 t -151.05 170.19 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.835 ' N ' HG13 ' B' ' 81' ' ' VAL . . . -130.18 157.73 41.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.652 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.742 HD11 HG21 ' B' ' 58' ' ' VAL . 0.1 OUTLIER -146.18 133.3 14.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.906 0.384 . . . . 0.0 111.537 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.679 ' HB2' ' CE1' ' B' ' 75' ' ' TYR . 0.5 OUTLIER -126.87 90.59 3.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.004 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 1.058 HD11 HG21 ' B' ' 42' ' ' ILE . 0.3 OUTLIER -90.74 130.74 36.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -178.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.782 ' CE1' HG21 ' B' ' 66' ' ' VAL . 1.6 p90 -169.15 120.97 0.75 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.833 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.732 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -87.67 162.99 16.79 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.909 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.835 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 3.0 m -115.87 19.25 15.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.184 0.516 . . . . 0.0 110.89 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.425 -1.208 . . . . 0.0 112.581 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.8 tttp . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.915 0.388 . . . . 0.0 111.121 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.066 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 59.41 175.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.34 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.737 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 3.8 t -144.59 73.05 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.546 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.999 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -43.24 130.2 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.883 0.373 . . . . 0.0 110.104 179.578 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.744 ' HE3' ' HB3' ' A' ' 77' ' ' TYR . 2.4 mmtp -120.91 -12.56 8.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.631 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.608 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 2.6 t30 -149.78 -92.1 0.07 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.383 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.882 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 67.21 -163.79 0.22 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.772 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.606 ' N ' ' O ' ' A' ' 73' ' ' PHE . 3.5 t0 169.34 31.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.967 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.892 ' SD ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -106.07 160.34 15.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.146 -179.439 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.573 ' O ' ' N ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -65.78 72.26 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.686 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 3.4 mt-10 32.92 -88.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.213 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 14' ' ' SER . 6.3 pt-20 -31.36 -32.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.108 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.722 ' HG3' ' CB ' ' A' ' 13' ' ' MET . 6.4 tpp -75.02 -45.53 41.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.054 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.686 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -63.22 -29.28 70.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 0.0 110.831 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -76.92 -45.07 29.22 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.752 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -68.68 -30.9 69.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.803 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.804 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.9 OUTLIER -64.55 -48.16 76.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.678 178.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.829 HG13 ' HB2' ' A' ' 6' ' ' ALA . 55.7 t -55.56 -50.48 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.183 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -52.88 -37.96 61.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.382 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.65 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 76.5 m -68.93 -36.85 78.46 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.147 0.499 . . . . 0.0 110.185 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 1.017 ' HA ' HD11 ' A' ' 42' ' ' ILE . . . -69.66 -30.06 67.65 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 1.054 ' HA ' HD12 ' A' ' 29' ' ' LEU . 94.8 m -74.08 -43.29 58.22 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.103 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.831 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -52.66 -44.16 66.0 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.075 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.831 ' N ' ' HG3' ' A' ' 27' ' ' GLN . . . -75.47 -26.58 58.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.205 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 1.054 HD12 ' HA ' ' A' ' 26' ' ' THR . 3.6 mt -67.72 -44.93 76.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.374 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -81.0 -28.98 35.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.053 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.54 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.6 OUTLIER -77.43 -31.04 53.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.972 0.415 . . . . 0.0 110.92 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.641 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -160.82 138.86 9.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.511 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -100.97 27.84 5.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 0.0 110.627 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.744 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 50.4 mm -99.63 91.62 2.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.966 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.713 ' HB3' ' CA ' ' B' ' 63' ' ' GLY . 4.1 mp0 -23.25 -78.93 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.144 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.666 ' HD2' ' CG2' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.42 -42.3 3.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.899 179.725 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.744 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.3 t0 -63.61 -60.73 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.993 0.425 . . . . 0.0 110.583 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.849 HG21 HD13 ' A' ' 42' ' ' ILE . 41.0 mt -47.97 -40.23 8.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.409 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.922 ' HB1' HG13 ' A' ' 58' ' ' VAL . . . -69.31 -41.78 76.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.39 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.746 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -54.39 -57.46 11.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.225 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.575 ' NE2' ' O ' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -59.17 -57.32 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.98 -179.874 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 1.017 HD11 ' HA ' ' A' ' 25' ' ' ALA . 91.8 mt -38.67 -45.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.337 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.739 ' HD3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -68.3 -59.61 3.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.019 -179.77 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.445 ' O ' ' OD2' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -43.76 -51.23 7.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.294 -179.656 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 5.0 tt0 -65.74 -49.31 68.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.991 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.804 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -58.21 -27.98 64.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.767 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -81.01 -34.11 33.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 5.95 47.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.125 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -126.44 -5.69 6.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.871 179.922 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.752 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 53.8 m-85 -136.82 -63.93 0.6 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.065 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.672 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 7.1 t-20 160.82 110.59 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.38 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.767 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 35.1 Cg_exo -58.38 157.69 25.55 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.433 2.088 . . . . 0.0 112.478 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.765 HG23 ' NE2' ' A' ' 55' ' ' HIS . 11.1 t -108.84 139.0 44.27 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.932 0.493 . . . . 0.0 110.49 -0.101 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.823 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 62.2 m95 -101.9 121.14 41.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.2 0.524 . . . . 0.0 112.193 -178.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.875 ' NE2' HG21 ' B' ' 67' ' ' THR . 0.1 OUTLIER -103.36 93.71 5.11 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.436 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.678 ' HB3' ' HG ' ' A' ' 85' ' ' LEU . 1.6 p -112.78 161.7 16.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.323 0.583 . . . . 0.0 112.489 -178.008 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.974 HD11 ' HA ' ' B' ' 64' ' ' SER . 21.9 mm -134.15 159.01 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.036 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.922 HG13 ' HB1' ' A' ' 39' ' ' ALA . 4.3 p -157.59 107.7 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.881 0.372 . . . . 0.0 111.531 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.752 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -143.58 -153.67 5.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.207 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.703 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.68 28.5 0.1 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.628 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.703 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 30.5 t30 167.94 27.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.458 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.988 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -98.54 -157.24 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.978 179.721 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.584 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -154.85 81.17 0.17 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.118 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.793 ' HA ' HG12 ' B' ' 57' ' ' ILE . 74.0 p -66.69 161.2 23.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.012 0.435 . . . . 0.0 111.326 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.759 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 63.3 t80 -167.8 45.32 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.484 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.8 HG11 ' HB3' ' B' ' 55' ' ' HIS . 3.5 m -97.56 152.44 4.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.872 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.908 HG21 HG23 ' B' ' 53' ' ' THR . 1.0 OUTLIER -96.96 147.96 23.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.995 -179.778 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.498 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -97.74 169.81 9.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.687 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.529 ' O ' HG22 ' A' ' 70' ' ' THR . 2.6 pt-20 -170.31 69.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.106 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.529 HG22 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 167.24 -110.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.231 179.822 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.703 ' O ' ' HA ' ' A' ' 13' ' ' MET . 20.5 pttm -162.19 6.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.662 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.84 ' HB2' ' HD3' ' A' ' 87' ' ' LYS . 2.1 m-70 -117.35 61.88 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.949 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.709 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.3 t80 -133.69 94.77 3.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.746 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.892 ' HB ' ' SD ' ' A' ' 13' ' ' MET . 2.4 tt -110.18 134.82 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.304 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.62 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 3.4 t80 -127.15 88.86 2.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.231 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.999 ' HB3' HG13 ' A' ' 8' ' ' ILE . 3.1 p90 -114.86 174.35 6.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.36 -179.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.744 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 24.2 t80 -130.61 105.23 7.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.749 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.066 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.3 mm? -55.05 163.99 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.912 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.478 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.27 -47.38 0.18 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.54 20.09 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.709 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.752 HG13 ' O ' ' A' ' 59' ' ' GLY . 28.3 t -139.19 177.4 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.705 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.772 ' O ' ' HA ' ' A' ' 58' ' ' VAL . . . -138.24 151.15 47.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.55 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.702 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -141.89 122.04 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.957 0.408 . . . . 0.0 111.039 -179.696 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.935 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 4.7 tp -109.82 85.05 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.678 ' HG ' ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -87.84 137.91 31.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' A' ' 72' ' ' HIS . 1.6 p90 -179.26 132.01 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.373 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.84 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 1.2 mtpm? -102.49 -157.68 0.62 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.782 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.418 0 CA-C-O 121.319 0.58 . . . . 0.0 110.569 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.511 ' H ' ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.847 0.356 . . . . 0.0 110.84 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.595 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.0 OUTLIER 49.12 29.45 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.917 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.062 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -123.78 -168.3 1.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.302 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.639 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 40.2 t -153.46 76.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.209 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.761 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.4 mp -35.04 146.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.538 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.881 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 8.8 mmpt? -121.74 -23.39 5.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.376 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.492 HD21 ' HZ ' ' B' ' 73' ' ' PHE . 5.2 t30 -153.11 -86.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.334 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.805 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 59.05 120.49 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.672 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.656 ' HB2' ' CE1' ' B' ' 73' ' ' PHE . 0.5 OUTLIER -117.75 25.12 10.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.261 0.553 . . . . 0.0 110.263 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.727 ' HG3' ' H ' ' B' ' 14' ' ' SER . 14.0 ttp -108.45 169.78 8.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.756 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.727 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.8 OUTLIER -52.51 132.88 35.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.798 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -42.73 -65.96 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.902 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -43.86 -34.12 1.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.804 ' SD ' ' HD3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -73.49 -32.72 64.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.892 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.9 OUTLIER -68.48 -37.58 80.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.89 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.647 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -73.62 -38.35 65.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.35 -35.07 71.04 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.657 -0.702 . . . . 0.0 109.759 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.809 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -63.66 -40.82 97.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.844 179.131 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.797 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 27.5 t -63.57 -44.6 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.304 179.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.647 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 51.5 mt-10 -57.59 -38.73 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.424 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.891 ' HB3' HG21 ' B' ' 42' ' ' ILE . 0.0 OUTLIER -67.82 -36.62 80.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.318 179.53 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.671 ' HA ' HG12 ' B' ' 42' ' ' ILE . . . -71.7 -30.08 65.28 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.836 ' HA ' HD11 ' B' ' 29' ' ' LEU . 11.4 m -73.29 -39.24 65.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.619 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.826 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -57.74 -43.7 85.56 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.404 178.826 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 1.005 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -68.8 -37.86 79.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.181 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.836 HD11 ' HA ' ' B' ' 26' ' ' THR . 1.4 mt -63.33 -39.5 94.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.779 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.16 -23.36 38.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.919 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.735 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -86.8 -25.36 24.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.811 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.601 ' HE2' ' HB2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -157.63 175.1 14.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.59 ' OD1' HD12 ' B' ' 34' ' ' ILE . 25.0 p30 -133.62 38.4 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.081 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.886 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 5.0 mm -121.4 106.16 17.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.67 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.681 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 3.2 mp0 -29.52 -70.5 0.05 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.937 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.421 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.87 -37.84 14.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.622 179.603 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.886 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 20.0 t0 -66.92 -60.26 2.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 1.005 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 4.3 mt -47.71 -47.34 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.769 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.847 ' N ' HG13 ' B' ' 58' ' ' VAL . . . -55.66 -50.37 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.636 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.759 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -56.44 -62.1 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.56 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.826 ' NE2' ' HB3' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -36.18 -55.02 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.234 179.436 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.891 HG21 ' HB3' ' B' ' 24' ' ' CYS . 16.3 mt -51.39 -69.98 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.089 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.827 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.0 OUTLIER -34.94 -63.34 0.32 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.414 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 0.3 OUTLIER -46.21 -41.63 13.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.114 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.776 ' HB3' ' SG ' ' B' ' 24' ' ' CYS . 2.0 tp10 -69.36 -44.16 72.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.89 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.809 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -65.9 -29.86 70.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.929 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.937 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.63 -40.56 66.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.693 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.503 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.12 -17.97 26.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.052 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.723 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.6 OUTLIER -88.34 -36.42 16.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.763 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.703 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 2.1 m-85 -123.46 -57.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.101 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.703 ' HB3' ' O ' ' B' ' 50' ' ' TYR . 5.9 p-10 154.3 119.62 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.105 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.747 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.937 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 19.2 Cg_endo -59.09 168.49 4.56 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.254 1.969 . . . . 0.0 112.556 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.908 HG23 HG21 ' A' ' 67' ' ' THR . 1.2 t -112.7 119.16 37.13 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 122.726 0.41 . . . . 0.0 111.001 0.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.797 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 26.6 m95 -91.2 113.74 26.08 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.38 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.8 ' HB3' HG11 ' A' ' 66' ' ' VAL . 3.2 m-70 -72.55 116.13 12.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.827 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 3.6 m -114.95 135.8 53.82 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.278 0.561 . . . . 0.0 112.438 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.793 HG12 ' HA ' ' A' ' 64' ' ' SER . 13.7 mt -139.98 104.92 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.02 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.847 HG13 ' N ' ' B' ' 39' ' ' ALA . 2.8 p -112.52 125.81 69.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.684 -179.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.748 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -146.14 -131.33 2.25 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.682 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -165.69 -0.34 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 120.774 0.321 . . . . 0.0 111.091 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -173.96 34.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.988 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.8 p90 -93.67 163.42 13.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.675 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.713 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -118.15 80.27 0.31 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.815 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.974 ' HA ' HD11 ' A' ' 57' ' ' ILE . 16.0 p -77.9 128.02 33.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 111.368 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.746 ' CD1' ' HA ' ' A' ' 40' ' ' ALA . 25.2 t80 -136.85 68.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.348 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.822 HG11 HD13 ' A' ' 57' ' ' ILE . 29.8 m -111.58 151.81 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.107 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.875 HG21 ' NE2' ' A' ' 55' ' ' HIS . 3.7 t -80.97 120.12 24.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.885 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.695 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -60.0 157.27 13.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.566 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 2.3 mt-10 -148.77 151.85 35.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.97 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.54 ' CG2' ' N ' ' B' ' 71' ' ' LYS . 42.2 m 57.63 -107.64 0.38 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.556 -179.676 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.804 ' HD3' ' SD ' ' B' ' 17' ' ' MET . 26.7 mttp -72.2 8.29 1.37 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.433 . . . . 0.0 110.375 179.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.762 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 24.8 m-70 79.6 -86.78 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.431 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.762 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 160.91 -175.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.745 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.892 HG13 ' HB3' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -158.13 117.58 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.099 179.626 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.809 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 13.2 t80 -108.15 139.21 43.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.605 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.797 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 1.3 p90 -160.32 169.98 22.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.608 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.618 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 23.5 t80 -132.02 113.83 13.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.062 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.4 mm? -70.93 169.43 14.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.781 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.51 -51.82 0.05 OUTLIER Glycine 0 C--N 1.333 0.372 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.845 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.693 ' O ' HG22 ' B' ' 81' ' ' VAL . 3.0 tt0 -143.25 41.61 1.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.81 0.338 . . . . 0.0 110.405 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.809 HG13 ' H ' ' B' ' 82' ' ' ALA . 60.4 t -157.9 169.9 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.189 -179.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.809 ' H ' HG13 ' B' ' 81' ' ' VAL . . . -135.12 141.74 46.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.329 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.739 ' CG1' HD22 ' B' ' 78' ' ' LEU . 0.2 OUTLIER -128.79 130.53 68.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.085 0.469 . . . . 0.0 111.939 -179.416 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.686 HD22 ' HB ' ' B' ' 57' ' ' ILE . 0.4 OUTLIER -117.33 97.88 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.641 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 1.2 mp -101.09 112.43 24.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.403 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.75 ' CE1' HG23 ' B' ' 66' ' ' VAL . 6.7 p90 -149.71 128.8 12.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.752 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.797 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 42.4 mtpt -93.4 170.12 9.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.296 -179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.76 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -119.2 19.27 12.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.638 179.728 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . 0.538 ' HA2' ' HG1' ' B' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.459 -1.189 . . . . 0.0 112.544 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.7 ' O ' HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.916 0.388 . . . . 0.0 110.859 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.093 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 81.47 152.29 0.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.437 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.565 ' O ' HG13 ' A' ' 7' ' ' VAL . 55.5 t -113.89 74.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.809 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.873 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -39.01 158.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.676 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -151.69 -8.92 0.22 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.764 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.538 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -172.95 92.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.41 180.0 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.821 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -128.76 77.04 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.786 -179.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.573 ' O ' ' HB2' ' A' ' 72' ' ' HIS . 0.2 OUTLIER -73.72 26.94 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.064 179.104 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.853 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -111.84 171.24 7.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.564 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.853 ' N ' ' HG2' ' A' ' 13' ' ' MET . 18.9 m -56.47 151.56 13.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.767 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -56.26 -65.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.956 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.726 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -51.39 -25.23 5.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.759 ' HE1' ' CD2' ' A' ' 50' ' ' TYR . 68.1 mmm -78.77 -36.23 43.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.061 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.735 ' CA ' HD13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -73.34 -36.81 66.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.68 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 37.0 mt-30 -74.74 -36.33 62.64 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.726 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -73.02 -31.72 64.65 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.678 178.918 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.779 ' OG ' HG21 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -64.77 -46.18 83.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.835 179.142 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.824 HG11 ' HB3' ' A' ' 6' ' ' ALA . 97.2 t -60.06 -50.66 79.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.405 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.68 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 6.5 mt-10 -52.97 -37.94 61.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.364 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.404 ' SG ' ' CE1' ' A' ' 46' ' ' PHE . 56.9 m -65.19 -40.27 93.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.135 0.493 . . . . 0.0 110.056 179.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.938 ' HB1' HG22 ' A' ' 83' ' ' ILE . . . -68.42 -33.39 74.14 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.712 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -71.51 -35.97 70.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.748 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.576 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 1.6 mt-30 -57.4 -42.96 83.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.373 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 1.048 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -85.93 -24.16 26.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.862 HD23 HG11 ' A' ' 81' ' ' VAL . 4.7 mt -75.51 -26.35 58.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.728 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.47 -35.27 11.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.607 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.576 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -83.96 -8.59 59.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.321 179.541 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.634 ' CD2' ' HE1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -154.17 -174.57 5.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.791 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -154.57 26.2 0.45 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.569 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 1.047 ' HB ' ' HB3' ' A' ' 37' ' ' ASP . 11.5 mm -116.01 102.24 13.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.836 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.836 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 4.5 mp0 -25.28 -78.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.183 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.775 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -41.56 -46.24 3.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.703 179.63 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 1.047 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -58.03 -60.04 4.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.779 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 1.048 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 2.1 mt -48.61 -46.92 15.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.839 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.811 ' HB2' ' HB3' ' B' ' 65' ' ' TYR . . . -59.92 -53.14 61.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.04 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.688 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -42.16 -56.65 2.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.634 ' HE1' ' CD2' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -59.69 -57.04 14.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.907 -179.974 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.866 HG22 HD13 ' A' ' 85' ' ' LEU . 56.5 mt -42.9 -68.13 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.14 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.734 ' HB3' ' CD2' ' B' ' 65' ' ' TYR . 1.5 tmtt? -50.9 -34.85 30.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.94 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.641 ' HZ1' ' HH ' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -61.03 -68.94 0.26 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.861 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.593 ' O ' ' N ' ' A' ' 49' ' ' LYS . 39.8 mt-10 -48.23 -54.05 14.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.776 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.8 OUTLIER -45.9 -51.66 12.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.796 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.784 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -64.23 -23.35 67.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.172 -179.837 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.58 11.43 18.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.242 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.593 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -130.4 -8.62 4.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.743 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.759 ' CD2' ' HE1' ' A' ' 17' ' ' MET . 84.0 m-85 -136.58 -63.5 0.62 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.85 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.558 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 0.5 OUTLIER 157.25 117.98 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.258 -179.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.784 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 20.6 Cg_endo -60.86 167.08 9.23 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.422 2.081 . . . . 0.0 112.42 -179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.75 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.0 OUTLIER -108.86 122.18 46.66 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.039 0.536 . . . . 0.0 110.803 0.046 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.807 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 36.5 m95 -93.48 149.92 20.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 112.034 -179.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.899 ' HB3' HG12 ' B' ' 66' ' ' VAL . 5.4 m-70 -127.37 103.49 7.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.418 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.82 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.6 OUTLIER -112.45 132.41 55.07 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.503 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.946 HG21 HG23 ' B' ' 57' ' ' ILE . 29.1 mm -120.24 107.17 20.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.167 178.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.823 HG11 ' HB ' ' A' ' 38' ' ' ILE . 4.8 p -107.5 131.21 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.966 0.412 . . . . 0.0 111.609 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.753 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -154.9 -142.79 3.52 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.817 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.436 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -160.21 3.58 0.08 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.743 0.272 . . . . 0.0 111.679 -179.856 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -177.4 31.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.422 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 1.068 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -92.37 -160.28 0.73 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.964 0.412 . . . . 0.0 110.983 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.719 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -152.72 78.59 0.2 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.034 -0.603 . . . . 0.0 111.941 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.927 ' HA ' HD13 ' B' ' 57' ' ' ILE . 25.6 p -72.9 140.27 47.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.972 0.415 . . . . 0.0 111.142 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.81 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 61.2 t80 -152.68 84.17 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.513 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.923 HG12 ' HB3' ' B' ' 55' ' ' HIS . 3.2 m -132.21 168.08 24.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.282 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.531 HG22 ' CG2' ' B' ' 53' ' ' THR . 1.3 t -83.78 -178.48 7.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.616 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.724 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -130.13 153.03 48.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.705 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.929 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 5.3 mm-40 -127.05 -124.61 0.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.272 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.563 ' HG1' ' H ' ' A' ' 71' ' ' LYS . 11.2 p -31.11 -99.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.779 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.691 ' O ' ' HB2' ' A' ' 13' ' ' MET . 3.0 mmtp -73.18 27.61 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.093 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.757 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 21.1 m-70 62.05 -90.63 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.757 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER 161.66 158.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.503 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.821 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 0.7 OUTLIER -127.77 134.7 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.023 0.44 . . . . 0.0 111.301 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.781 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 1.4 t80 -124.79 138.84 54.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.161 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.873 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.6 OUTLIER -163.65 164.45 23.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.876 0.37 . . . . 0.0 111.032 -179.692 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.788 ' HD1' ' HB1' ' A' ' 82' ' ' ALA . 74.6 t80 -127.49 94.52 4.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.081 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.093 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.6 mm? -44.05 158.21 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.855 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.455 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.92 -28.91 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.639 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.76 ' O ' HG23 ' A' ' 81' ' ' VAL . 13.5 pt20 -153.13 33.41 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.918 0.39 . . . . 0.0 110.946 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.871 HG13 ' N ' ' A' ' 82' ' ' ALA . 72.6 t -156.48 170.89 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.871 ' N ' HG13 ' A' ' 81' ' ' VAL . . . -136.56 119.05 15.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.858 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.938 HG22 ' HB1' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -111.6 129.33 67.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.003 0.43 . . . . 0.0 111.612 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.806 HD23 HG12 ' A' ' 57' ' ' ILE . 0.6 OUTLIER -116.22 92.0 3.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.279 179.647 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.866 HD13 HG22 ' A' ' 42' ' ' ILE . 3.1 mp -92.85 135.15 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.003 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.752 ' CE1' HG22 ' A' ' 66' ' ' VAL . 1.4 p90 -171.65 121.14 0.49 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.058 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.807 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 1.8 ptmt -104.53 143.16 33.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.785 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.929 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 110.814 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.743 ' O ' ' HG3' ' B' ' 4' ' ' ARG . 7.8 tpt180 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 121.004 0.431 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.503 ' O ' HD12 ' B' ' 78' ' ' LEU . 13.3 tttt -30.62 111.62 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.935 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.017 ' HB1' HG13 ' B' ' 22' ' ' VAL . . . 160.74 -172.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.853 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.773 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 53.0 t -150.36 71.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.813 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.98 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.84 143.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.973 -179.803 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.773 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 8.8 mmpt? -112.17 -28.41 7.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.923 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.736 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -157.5 -91.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.241 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.858 ' HB2' ' NE2' ' B' ' 18' ' ' GLN . . . 78.44 97.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.066 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.2 t0 -90.47 29.84 1.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.18 0.514 . . . . 0.0 109.975 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.996 ' HE3' HG22 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -116.25 153.26 32.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.606 -179.66 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.758 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -37.0 154.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.546 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -61.79 -68.22 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.794 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -48.3 -24.06 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.666 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.901 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -76.88 -42.56 39.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.851 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 1.087 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -65.32 -29.15 69.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.035 0.445 . . . . 0.0 110.252 179.525 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.501 ' NE2' ' HD3' ' B' ' 4' ' ' ARG . 4.3 mm100 -77.59 -43.26 32.23 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.28 0.562 . . . . 0.0 109.598 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.833 ' HB3' ' HH ' ' B' ' 50' ' ' TYR . 0.9 OUTLIER -69.78 -27.69 65.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.682 178.895 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.791 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 2.5 t -68.04 -49.56 60.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.928 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 1.017 HG13 ' HB1' ' B' ' 6' ' ' ALA . 76.7 t -55.77 -46.54 79.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.156 179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.53 -40.26 86.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.023 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.619 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 1.3 m -66.68 -34.28 77.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.759 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.648 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -71.45 -32.26 68.11 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.877 ' HA ' HD11 ' B' ' 29' ' ' LEU . 12.4 m -70.94 -41.25 71.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.142 -1.39 . . . . 0.0 109.858 178.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.777 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 3.3 mm100 -55.83 -46.9 78.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.752 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.896 ' HB2' ' HB3' ' B' ' 41' ' ' HIS . . . -65.58 -34.39 78.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.403 179.239 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.877 HD11 ' HA ' ' B' ' 26' ' ' THR . 1.4 mt -66.21 -50.18 64.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.16 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -66.7 -27.59 67.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.013 -179.811 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.777 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 28.0 mmtp -85.68 -26.81 25.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.89 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.63 ' HH ' ' HD1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -157.33 151.78 25.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.729 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.532 ' C ' HD12 ' B' ' 34' ' ' ILE . 1.5 p30 -113.28 36.37 3.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.903 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.789 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.6 mm -118.98 108.72 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.719 ' HB3' ' HA3' ' A' ' 63' ' ' GLY . 54.7 mm-40 -29.7 -71.08 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.024 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.444 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.1 OUTLIER -46.32 -45.99 17.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.895 0.379 . . . . 0.0 110.646 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.789 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 15.0 t0 -58.92 -61.28 2.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.85 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.835 ' HA ' ' HB3' ' B' ' 28' ' ' ALA . 2.1 mt -43.93 -47.75 2.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.816 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 1.011 ' HB1' HG12 ' B' ' 58' ' ' VAL . . . -57.14 -59.43 5.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.529 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -45.63 -61.57 1.65 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.896 ' HB3' ' HB2' ' B' ' 28' ' ' ALA . 0.9 OUTLIER -41.62 -49.04 4.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.264 179.387 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.648 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 18.8 mt -61.51 -68.64 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.793 ' HE2' ' HB3' ' B' ' 47' ' ' ASP . 1.4 tptm -39.62 -27.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.68 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -75.98 -60.34 2.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.0 0.429 . . . . 0.0 110.858 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.71 ' HG2' ' O ' ' B' ' 41' ' ' HIS . 0.4 OUTLIER -60.56 -25.88 66.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.04 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.791 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -76.86 -48.04 19.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.419 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.793 ' HB3' ' HE2' ' B' ' 43' ' ' LYS . 3.2 p30 -64.21 -27.17 68.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.274 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.431 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -90.03 -41.61 11.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.029 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.659 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -79.04 -20.02 49.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.048 -179.632 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.833 ' HH ' ' HB3' ' B' ' 20' ' ' ASP . 8.9 m-85 -128.66 -70.03 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.452 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.795 HD21 ' HD2' ' B' ' 52' ' ' PRO . 1.3 t-20 157.38 117.58 0.0 OUTLIER Pre-proline 0 CA--C 1.529 0.163 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.479 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.795 ' HD2' HD21 ' B' ' 51' ' ' ASN . 30.1 Cg_endo -63.01 170.1 8.03 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.369 2.046 . . . . 0.0 112.526 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.621 ' HA ' ' HE3' ' B' ' 43' ' ' LYS . 0.6 OUTLIER -103.54 132.49 49.74 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 122.822 0.449 . . . . 0.0 110.544 0.041 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.779 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 46.4 m95 -101.62 104.66 15.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.574 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.923 ' HB3' HG12 ' A' ' 66' ' ' VAL . 37.1 m-70 -69.42 90.71 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.77 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 23.8 p -105.06 123.73 48.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.059 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.946 HG23 HG21 ' A' ' 57' ' ' ILE . 19.0 mm -118.08 108.28 24.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.088 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 1.011 HG12 ' HB1' ' B' ' 39' ' ' ALA . 2.4 p -111.07 120.91 62.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.868 0.366 . . . . 0.0 111.369 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.633 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.77 -136.09 3.47 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.063 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.477 ' O ' ' OD1' ' B' ' 61' ' ' ASN . 0.4 OUTLIER -162.67 5.61 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 120.873 0.368 . . . . 0.0 111.13 -179.568 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.477 ' OD1' ' O ' ' B' ' 60' ' ' ARG . 0.8 OUTLIER 171.18 31.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 1.068 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -89.29 -170.4 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.024 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.836 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -139.46 76.92 0.33 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.081 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.919 ' HA ' HD12 ' A' ' 57' ' ' ILE . 9.6 p -69.66 138.12 52.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.012 0.434 . . . . 0.0 111.191 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.811 ' HB3' ' HB2' ' A' ' 39' ' ' ALA . 68.3 t80 -146.24 88.55 1.8 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.899 HG12 ' HB3' ' A' ' 55' ' ' HIS . 10.2 m -125.74 145.68 32.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.348 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.75 HG21 ' CG2' ' A' ' 53' ' ' THR . 0.0 OUTLIER -80.13 70.05 6.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.632 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.538 ' CD2' ' CD2' ' B' ' 73' ' ' PHE . 1.6 p-80 -51.24 160.91 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' B' ' 71' ' ' LYS . 0.8 OUTLIER -156.84 -144.75 0.14 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.768 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.681 ' HG1' ' N ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 39.99 -90.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.717 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.5 OUTLIER 163.21 21.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 179.938 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.492 ' HB3' ' CZ3' ' B' ' 54' ' ' TRP . 39.6 m80 -115.96 52.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.765 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.858 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.9 t80 -127.34 123.92 37.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 1.087 HG13 ' HB3' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -135.42 117.36 20.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.537 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.568 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -103.35 134.74 46.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.007 178.972 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.98 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.5 OUTLIER -162.68 169.15 20.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.902 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.692 ' HH ' ' HA ' ' B' ' 80' ' ' GLN . 49.4 t80 -135.38 115.77 13.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.756 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 0.967 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -68.77 169.99 10.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.763 -179.769 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.427 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -35.09 -35.46 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.742 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.692 ' HA ' ' HH ' ' B' ' 77' ' ' TYR . 1.4 pt20 -154.38 33.8 0.42 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.823 0.344 . . . . 0.0 111.134 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.592 ' O ' ' N ' ' B' ' 78' ' ' LEU . 55.3 t -152.83 168.22 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.613 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.702 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -131.62 152.29 50.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.819 0.343 . . . . 0.0 111.111 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.552 HG13 ' CE2' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -141.95 123.77 13.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.393 -179.628 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.838 HD21 ' HB2' ' B' ' 64' ' ' SER . 0.4 OUTLIER -117.89 90.2 3.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.404 179.756 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.762 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -94.64 130.78 40.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.618 -179.442 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.858 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 16.8 p90 -169.01 132.53 1.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.476 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.779 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 1.2 mtpp -108.16 170.47 7.98 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.733 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.7 ' HB2' ' HE2' ' B' ' 55' ' ' HIS . 0.2 OUTLIER -122.01 19.89 10.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.306 0.574 . . . . 0.0 110.998 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.426 -1.208 . . . . 0.0 112.598 -179.919 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.724 ' O ' HD12 ' A' ' 78' ' ' LEU . 22.3 tptm . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.865 0.364 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.016 ' HB2' HD11 ' A' ' 78' ' ' LEU . . . -128.28 173.7 9.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.406 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.793 HG13 ' HE2' ' A' ' 9' ' ' LYS . 38.5 t -132.7 81.32 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.674 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.904 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -50.32 150.62 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.978 0.418 . . . . 0.0 110.505 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.793 ' HE2' HG13 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -159.42 1.11 0.08 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.787 -179.771 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.786 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 0.1 OUTLIER -160.25 77.55 0.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.553 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.676 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.06 174.35 6.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.232 0.539 . . . . 0.0 111.879 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.674 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -174.03 28.51 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.398 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.848 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 16.0 ttp -124.45 171.15 10.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.688 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.718 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.4 OUTLIER -53.57 138.24 34.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.656 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -43.95 -67.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.514 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -48.15 -34.13 9.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.94 -179.994 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.733 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 47.2 mmm -68.92 -29.83 68.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.862 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.909 ' HB3' HD13 ' A' ' 74' ' ' ILE . 1.6 mm100 -74.21 -39.09 63.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.654 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.731 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 6.9 mt-30 -74.83 -34.23 62.3 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.514 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.3 OUTLIER -73.53 -36.86 65.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.642 178.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.712 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 56.6 p -62.91 -47.38 83.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.835 178.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.804 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 26.3 t -57.64 -49.97 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.731 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 40.9 mt-10 -55.14 -38.57 68.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.213 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.69 -37.39 84.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.187 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.691 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -70.93 -27.83 64.05 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 178.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.565 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 5.3 m -73.85 -39.99 63.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.355 178.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.581 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -56.51 -45.36 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.629 178.971 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.978 ' HB1' HG21 ' A' ' 38' ' ' ILE . . . -75.3 -23.38 57.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.752 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.581 HD23 ' CG1' ' A' ' 81' ' ' VAL . 7.0 mt -73.94 -34.02 64.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -94.17 -21.75 18.88 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.533 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.593 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 41.0 mmtm -90.1 -13.16 36.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.676 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.68 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -152.26 -142.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.584 ' HA ' HD12 ' A' ' 38' ' ' ILE . 0.6 OUTLIER 159.88 34.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.501 179.796 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.915 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 33.2 mm -113.97 39.21 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.184 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.785 ' N ' HD11 ' A' ' 38' ' ' ILE . 3.6 mp0 36.69 -87.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.58 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.679 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.06 -43.42 3.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.378 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.915 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.9 t70 -60.45 -57.62 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.335 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.978 HG21 ' HB1' ' A' ' 28' ' ' ALA . 3.2 mt -48.3 -55.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.856 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.792 ' N ' HG12 ' A' ' 58' ' ' VAL . . . -53.1 -46.65 68.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.88 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.752 ' HB3' ' CE1' ' B' ' 65' ' ' TYR . . . -52.03 -54.56 28.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.054 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.801 ' HD1' ' HB3' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -60.82 -55.21 35.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.737 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.812 HD11 HG22 ' A' ' 38' ' ' ILE . 76.3 mt -44.31 -56.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.137 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.847 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.2 OUTLIER -53.42 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.754 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.564 ' HA ' ' OD2' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -35.61 -53.81 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.565 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.2 mm-40 -51.37 -58.94 4.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.78 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.726 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 3.0 m-85 -52.35 -48.6 65.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.786 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.8 ' HB2' ' HB3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -61.54 -19.25 61.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.653 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.412 ' HE3' ' CA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -121.34 12.3 10.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.848 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.0 OUTLIER -124.44 -16.87 6.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.096 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.712 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 27.1 m-85 -140.1 -55.36 0.54 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.801 0.334 . . . . 0.0 111.238 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.712 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 3.5 t30 160.1 119.77 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.169 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.314 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.8 ' HB3' ' HB2' ' A' ' 47' ' ' ASP . 39.4 Cg_endo -67.02 166.87 21.47 Favored 'Trans proline' 0 CA--C 1.532 0.399 0 C-N-CA 122.464 2.109 . . . . 0.0 112.344 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.68 HG22 ' CE1' ' A' ' 55' ' ' HIS . 3.7 m -106.64 128.28 54.04 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 122.817 0.447 . . . . 0.0 110.77 0.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.773 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.7 m95 -94.64 123.38 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.856 -179.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.887 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.0 OUTLIER -106.9 97.69 7.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.588 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.861 ' HB2' HD11 ' A' ' 85' ' ' LEU . 27.7 p -117.5 162.37 18.09 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.909 HD12 ' HA ' ' B' ' 64' ' ' SER . 16.5 mm -129.47 168.48 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.01 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.843 ' H ' HG22 ' A' ' 57' ' ' ILE . 5.9 p -165.04 110.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.899 0.38 . . . . 0.0 111.479 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.759 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -146.48 -128.14 1.9 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.205 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.572 ' HG3' ' NH1' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -167.14 -37.67 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.785 0.326 . . . . 0.0 111.121 -179.755 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -140.16 52.61 1.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.247 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 1.038 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.4 OUTLIER -110.11 168.46 9.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.374 . . . . 0.0 110.758 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.889 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -115.1 81.31 0.3 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.959 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.925 ' HA ' HG12 ' B' ' 57' ' ' ILE . 1.0 OUTLIER -76.06 137.95 40.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.968 0.414 . . . . 0.0 111.472 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.892 ' HB2' ' HB1' ' B' ' 39' ' ' ALA . 9.1 t80 -151.16 65.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.42 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.685 HG11 ' CB ' ' B' ' 55' ' ' HIS . 28.5 m -112.78 161.74 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.187 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.713 HG22 ' N ' ' A' ' 68' ' ' HIS . 2.8 t -81.65 -149.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.952 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.713 ' N ' HG22 ' A' ' 67' ' ' THR . 5.7 p-80 179.59 161.2 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.711 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -161.64 165.07 28.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.041 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.468 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 9.1 m 68.72 -93.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.126 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.586 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER 168.3 67.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.848 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 95.9 m-70 -154.73 16.73 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.979 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 8.8 t80 -99.4 101.0 12.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.37 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.909 HD13 ' HB3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -123.56 118.87 55.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.958 0.408 . . . . 0.0 111.595 -179.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.786 ' HB3' ' HB3' ' A' ' 10' ' ' ASN . 75.9 t80 -112.76 135.03 53.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.111 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.904 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -150.13 176.55 10.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.877 0.37 . . . . 0.0 111.203 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.772 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 7.2 t80 -132.4 99.45 4.68 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.19 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.016 HD11 ' HB2' ' A' ' 6' ' ' ALA . 1.9 mm? -65.24 -174.83 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.329 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.46 ' O ' ' CB ' ' A' ' 80' ' ' GLN . . . -60.18 85.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.062 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.772 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 5.7 tt0 82.68 12.31 0.52 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.807 0.337 . . . . 0.0 110.739 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.868 HG12 ' H ' ' A' ' 82' ' ' ALA . 68.5 t -136.09 173.58 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.853 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.868 ' H ' HG12 ' A' ' 81' ' ' VAL . . . -148.99 154.67 39.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.858 0.361 . . . . 0.0 111.142 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.741 HD11 ' O ' ' A' ' 82' ' ' ALA . 0.4 OUTLIER -139.95 116.08 8.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.037 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.896 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 12.6 tp -97.98 86.52 3.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.785 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.861 HD11 ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -90.48 139.24 30.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.051 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.979 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.0 OUTLIER -172.53 121.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.355 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.807 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.8 OUTLIER -94.21 118.99 32.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.792 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.845 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-O 121.311 0.576 . . . . 0.0 110.784 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.668 ' HD2' ' OE1' ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.772 0.32 . . . . 0.0 110.765 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -89.99 36.08 0.86 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.073 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.055 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -110.52 -155.33 0.56 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.055 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.736 HG23 ' O ' ' B' ' 6' ' ' ALA . 6.8 t -158.36 67.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.134 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.898 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.1 mp -35.66 142.84 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 110.153 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.992 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 5.2 mmpt? -120.86 -22.41 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.589 HD21 ' C ' ' B' ' 10' ' ' ASN . 0.2 OUTLIER -150.21 -104.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.308 179.758 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.756 ' CB ' ' HA ' ' B' ' 74' ' ' ILE . . . 69.25 145.34 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.176 0.512 . . . . 0.0 111.743 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.545 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -145.17 25.49 1.39 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.647 179.216 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.633 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 20.1 ttp -102.04 166.47 10.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.989 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.716 ' HB2' ' HG3' ' B' ' 17' ' ' MET . 2.2 m -47.68 143.52 3.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.814 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.602 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 3.4 pt-20 -49.84 -69.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.864 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.756 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -47.34 -21.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.763 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.793 ' HE2' ' CH2' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -82.39 -37.73 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.017 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.866 ' HA ' HD11 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.26 -34.72 68.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.659 179.869 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.668 ' OE1' ' HD2' ' B' ' 4' ' ' ARG . 37.7 mt-30 -77.86 -40.42 40.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.927 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.756 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -69.15 -33.44 73.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.638 179.161 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.911 ' HB2' HD22 ' B' ' 85' ' ' LEU . 0.6 OUTLIER -65.48 -49.28 69.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.154 179.286 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.795 HG23 ' CD2' ' B' ' 76' ' ' PHE . 84.1 t -59.94 -37.11 70.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.162 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . 0.589 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 62.2 mt-10 -63.86 -35.05 79.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.344 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.476 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 3.5 t -72.82 -34.61 66.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 109.798 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.88 ' HA ' HD12 ' B' ' 42' ' ' ILE . . . -72.63 -35.04 67.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.866 ' HA ' HD13 ' B' ' 29' ' ' LEU . 51.7 m -69.83 -43.89 71.05 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.622 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.795 ' HG3' ' N ' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -52.73 -46.84 67.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.526 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.988 ' HB2' HG22 ' B' ' 38' ' ' ILE . . . -71.28 -24.14 62.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.721 178.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.908 HD12 ' HG ' ' B' ' 78' ' ' LEU . 3.5 mt -71.34 -36.82 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.543 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -86.74 -28.83 22.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.625 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.771 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 44.7 mmtm -84.25 -27.61 27.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.744 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -148.87 164.49 34.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.662 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . 0.438 ' C ' HD11 ' B' ' 34' ' ' ILE . 9.7 m120 -129.65 31.25 4.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 1.02 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.2 mm -113.7 107.1 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.889 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 13.9 mp0 -31.15 -67.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.545 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.749 ' HZ3' HG21 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -48.57 -60.69 2.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.789 179.594 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 1.02 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.2 m-20 -45.29 -65.1 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.664 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.988 HG22 ' HB2' ' B' ' 28' ' ' ALA . 9.9 mt -41.91 -46.74 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.127 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.892 ' HB1' ' HB2' ' A' ' 65' ' ' TYR . . . -64.88 -42.46 94.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.984 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.731 ' HB1' ' CE1' ' A' ' 65' ' ' TYR . . . -57.85 -59.44 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.156 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.627 ' CE1' ' HB3' ' B' ' 37' ' ' ASP . 0.0 OUTLIER -53.53 -55.06 28.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.661 179.985 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.88 HD12 ' HA ' ' B' ' 25' ' ' ALA . 37.7 mt -45.5 -69.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.677 ' HD2' ' HE2' ' A' ' 65' ' ' TYR . 4.4 tmtt? -45.21 -36.45 3.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.898 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.505 ' O ' ' HE2' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -65.94 -50.01 65.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.977 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.763 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.8 OUTLIER -64.86 -35.88 82.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.912 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.786 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -68.61 -40.52 80.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.029 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.773 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.43 -39.07 85.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.899 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -32.37 34.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.763 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.82 -13.28 39.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.776 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.704 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 98.6 m-85 -123.58 -73.23 0.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.48 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.704 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.6 t-20 159.21 113.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.172 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.773 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 78.5 Cg_exo -42.13 151.06 0.21 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.208 1.939 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.668 HG22 ' HE1' ' B' ' 55' ' ' HIS . 2.8 t -122.41 131.84 54.08 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 122.895 0.478 . . . . 0.0 110.51 0.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 1.028 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 53.3 m95 -96.16 126.01 41.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.716 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.694 ' HD1' ' N ' ' B' ' 55' ' ' HIS . 0.0 OUTLIER -98.13 94.08 6.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.092 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.765 ' HB3' ' CD1' ' B' ' 85' ' ' LEU . 1.8 m -112.61 169.68 8.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.437 0.637 . . . . 0.0 112.015 -177.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.925 HG12 ' HA ' ' A' ' 64' ' ' SER . 32.8 mt -158.34 162.19 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.346 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.864 HG13 ' HB ' ' B' ' 38' ' ' ILE . 2.2 p -159.54 114.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.003 0.43 . . . . 0.0 111.488 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.736 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -143.2 -133.92 2.82 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.942 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -172.88 10.03 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.778 0.323 . . . . 0.0 111.168 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.417 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -174.62 32.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.216 -179.908 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 1.038 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 8.8 p90 -102.81 168.34 9.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.05 0.452 . . . . 0.0 111.142 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -121.79 81.84 0.35 Allowed Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.064 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.909 ' HA ' HD12 ' A' ' 57' ' ' ILE . 8.7 p -75.88 123.27 25.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.959 0.409 . . . . 0.0 111.324 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.847 ' HE2' ' HD2' ' A' ' 43' ' ' LYS . 10.8 t80 -134.85 68.88 1.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.507 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.887 ' HB ' ' HB3' ' A' ' 55' ' ' HIS . 4.6 m -114.88 150.99 16.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.457 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 16.3 m -87.37 95.99 10.2 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.857 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.793 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 10.6 p-80 -61.87 159.08 14.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.546 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -152.65 -171.6 3.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.614 179.98 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.586 ' C ' ' H ' ' B' ' 72' ' ' HIS . 29.8 m 51.68 -119.54 1.47 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.413 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.48 ' H ' ' CG2' ' B' ' 70' ' ' THR . 55.5 mmtt -72.95 31.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 0.0 110.202 179.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.793 ' O ' ' HB2' ' B' ' 68' ' ' HIS . 63.2 m-70 61.49 -93.67 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.496 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.793 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 159.4 -161.06 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.866 HD11 ' HA ' ' B' ' 18' ' ' GLN . 0.5 OUTLIER -165.3 111.66 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.049 179.24 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.549 ' HE1' ' HZ ' ' B' ' 62' ' ' PHE . 9.6 t80 -110.12 98.27 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.898 ' HB3' HG13 ' B' ' 8' ' ' ILE . 3.6 p90 -118.58 169.67 9.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.617 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 31.2 t80 -132.27 113.21 12.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.522 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.055 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -70.39 169.87 13.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.73 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.509 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -24.76 -47.63 0.02 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.117 -0.564 . . . . 0.0 113.218 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.508 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -145.71 29.83 1.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.644 0.259 . . . . 0.0 111.142 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.775 HG11 ' N ' ' B' ' 82' ' ' ALA . 97.1 t -143.61 170.11 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.285 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.775 ' N ' HG11 ' B' ' 81' ' ' VAL . . . -137.1 126.09 24.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.552 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.657 ' CG1' HD22 ' B' ' 78' ' ' LEU . 0.3 OUTLIER -114.66 124.05 70.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.134 0.493 . . . . 0.0 111.832 -179.399 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.761 ' O ' ' HA ' ' B' ' 56' ' ' CYS . 0.2 OUTLIER -106.85 93.96 4.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.039 179.655 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.911 HD22 ' HB2' ' B' ' 21' ' ' SER . 0.5 OUTLIER -100.43 122.86 43.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.276 -179.414 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.671 ' CE1' HG22 ' B' ' 66' ' ' VAL . 18.3 p90 -163.83 115.06 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.319 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 1.028 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 5.6 ptmt -105.02 158.32 16.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.684 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.546 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.6 OUTLIER -95.52 19.45 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.229 0.538 . . . . 0.0 110.869 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . 0.747 ' HA2' ' CE ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.47 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.584 ' O ' HD11 ' A' ' 78' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.862 0.363 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.046 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -141.67 173.34 11.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.244 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.467 ' O ' ' HE3' ' A' ' 9' ' ' LYS . 39.0 t -139.05 75.78 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.033 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.833 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -38.89 160.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.13 0.49 . . . . 0.0 110.637 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.739 ' HD3' ' O ' ' A' ' 8' ' ' ILE . 2.8 mmtp -159.44 -6.96 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.63 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.477 ' CG ' ' HZ ' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -167.51 71.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.393 179.984 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.879 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -117.5 92.36 3.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.664 -179.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.795 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 53.7 m-20 -90.53 26.41 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.154 0.502 . . . . 0.0 110.246 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.773 ' HG3' ' H ' ' A' ' 14' ' ' SER . 16.0 ttp -109.85 173.33 6.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.773 ' H ' ' HG3' ' A' ' 13' ' ' MET . 1.2 t -57.91 140.85 51.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.86 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.561 ' HA ' ' CG ' ' A' ' 18' ' ' GLN . 11.9 mt-10 -47.98 -62.91 1.23 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.967 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.481 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 1.1 mt-10 -51.68 -31.62 26.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.56 ' HE2' ' CH2' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -72.57 -45.59 58.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.81 HE21 ' HB3' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -62.4 -36.86 83.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.943 179.957 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.555 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 10.2 mt-30 -73.57 -35.17 65.43 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.851 ' HB3' ' HH ' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -74.05 -27.74 61.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.699 178.917 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.4 t -71.22 -41.03 70.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.06 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.802 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 94.7 t -65.58 -46.67 88.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.613 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.703 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 58.2 mt-10 -57.97 -41.7 83.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.114 179.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 20.3 m -64.35 -37.04 86.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.758 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.803 ' HA ' HD12 ' A' ' 42' ' ' ILE . . . -69.99 -32.56 70.82 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.683 ' HA ' HD13 ' A' ' 29' ' ' LEU . 1.6 m -69.27 -38.82 78.56 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.47 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.773 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 57.5 mt-30 -59.22 -41.01 87.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.943 179.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 1.068 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -73.21 -31.72 64.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.132 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.683 HD13 ' HA ' ' A' ' 26' ' ' THR . 1.3 mt -72.13 -35.68 69.18 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.327 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -93.17 -11.78 31.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.352 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.773 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 8.4 mttm -96.43 -19.82 18.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.723 0.297 . . . . 0.0 111.216 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.593 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -151.46 -62.77 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.031 179.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.802 ' HA ' HD13 ' A' ' 38' ' ' ILE . 5.7 t-20 74.83 61.12 0.07 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.75 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 1.038 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 44.3 mm -141.21 57.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.011 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.628 ' O ' HG13 ' A' ' 58' ' ' VAL . 1.5 mp0 31.87 -91.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.974 0.416 . . . . 0.0 110.266 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.654 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -44.02 -54.03 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.214 179.105 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 1.038 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -52.26 -58.29 7.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.978 179.632 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 1.068 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 24.5 mt -48.22 -43.42 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.939 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.989 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -62.22 -49.62 75.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.765 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.805 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -53.26 -45.74 68.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.776 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.808 ' CD2' ' HB3' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -57.2 -58.44 8.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.622 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.803 HD12 ' HA ' ' A' ' 25' ' ' ALA . 8.0 mt -50.42 -74.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.367 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.729 ' HD3' ' CD2' ' B' ' 65' ' ' TYR . 7.6 tttt -39.11 -40.62 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.799 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.577 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.21 -62.36 1.7 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.038 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -60.48 -58.95 6.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.871 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.814 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.9 OUTLIER -42.02 -38.19 1.57 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.78 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -69.35 -43.74 73.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.837 -179.855 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.99 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -95.94 9.78 39.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.316 -179.844 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -129.96 -5.54 4.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.119 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.851 ' HH ' ' HB3' ' A' ' 20' ' ' ASP . 75.9 m-85 -138.39 -61.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.224 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.517 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.6 OUTLIER 158.8 109.62 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.223 -179.708 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.78 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 51.7 Cg_exo -54.23 148.81 39.26 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.39 2.06 . . . . 0.0 112.734 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.576 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.2 OUTLIER -117.42 144.12 45.31 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.882 0.473 . . . . 0.0 110.731 -0.021 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.633 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 70.7 m95 -101.19 114.88 29.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.499 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.79 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -86.3 92.31 8.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.812 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.76 ' HB3' HD11 ' A' ' 85' ' ' LEU . 0.4 OUTLIER -106.81 144.36 33.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.233 0.539 . . . . 0.0 112.293 -178.412 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.896 HG12 HD22 ' A' ' 84' ' ' LEU . 14.5 mm -132.81 107.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.341 179.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.997 HG21 HG23 ' A' ' 38' ' ' ILE . 3.1 p -107.47 129.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.954 0.407 . . . . 0.0 111.479 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.759 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.98 -127.07 1.06 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.057 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.508 ' O ' ' HE2' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -160.56 -54.48 0.05 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 120.746 0.307 . . . . 0.0 111.23 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.818 ' HB3' ' CZ ' ' B' ' 60' ' ' ARG . 0.1 OUTLIER -130.94 67.54 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.084 -179.792 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.808 ' HE2' ' HB3' ' A' ' 64' ' ' SER . 1.4 p90 -122.57 -166.02 1.37 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.872 0.368 . . . . 0.0 110.861 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.601 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -138.07 75.51 0.38 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.029 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.849 ' HG ' HD11 ' A' ' 84' ' ' LEU . 73.8 p -67.86 133.71 49.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.828 0.347 . . . . 0.0 111.177 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.863 ' HB2' ' HB1' ' B' ' 39' ' ' ALA . 16.1 t80 -151.42 79.54 1.29 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.897 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.699 HG23 ' CD1' ' A' ' 86' ' ' PHE . 21.2 m -110.09 176.67 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.039 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.793 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 55.1 m -107.01 108.97 20.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.83 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.605 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -57.89 157.39 7.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 179.938 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.725 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 9.9 mm-40 -136.96 -125.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.923 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.482 ' O ' ' O ' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -30.18 -97.61 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.225 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.541 ' HD3' ' SD ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -78.94 46.55 0.7 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.521 -179.972 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.795 ' ND1' ' HB3' ' A' ' 12' ' ' ASP . 18.8 m170 47.48 -90.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.623 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.749 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 4.7 p90 163.13 -160.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.594 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.879 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -168.08 129.8 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.581 179.743 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.547 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 15.4 t80 -123.19 136.14 54.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.612 178.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.833 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.2 OUTLIER -154.57 168.87 25.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.996 0.427 . . . . 0.0 111.193 -179.314 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.696 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 11.7 t80 -127.1 99.09 5.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.187 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.046 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -65.91 -175.06 0.27 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 179.76 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.436 ' O ' ' HB3' ' A' ' 80' ' ' GLN . . . -58.11 86.78 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.978 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.436 ' HB3' ' O ' ' A' ' 79' ' ' GLY . 48.0 tt0 78.01 23.25 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 0.0 110.195 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 59' ' ' GLY . 45.5 t -141.97 167.13 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.782 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.696 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -146.43 118.58 8.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.872 HG12 HD23 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -105.11 139.99 24.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.973 0.416 . . . . 0.0 111.609 -179.53 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.938 HD23 HD12 ' B' ' 57' ' ' ILE . 0.7 OUTLIER -124.7 94.53 4.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.378 179.644 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.76 HD11 ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -99.6 129.14 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.556 -179.318 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.79 ' CE1' ' HB2' ' A' ' 55' ' ' HIS . 1.4 p90 -166.32 119.37 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.909 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.633 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -105.82 151.79 24.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.067 -179.949 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.725 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.175 0.512 . . . . 0.0 110.809 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.58 ' NH1' ' HG3' ' B' ' 4' ' ' ARG . 3.2 mmm-85 . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.825 0.345 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.71 ' O ' HD11 ' B' ' 78' ' ' LEU . 0.0 OUTLIER 77.62 98.27 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.689 -179.869 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.035 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.03 -168.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.767 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.8 HG13 ' HE2' ' B' ' 9' ' ' LYS . 99.5 t -152.78 75.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.252 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.974 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -51.01 145.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.114 0.483 . . . . 0.0 110.419 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.8 ' HE2' HG13 ' B' ' 7' ' ' VAL . 0.5 OUTLIER -142.16 -10.3 0.87 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.156 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.551 ' CG ' ' HZ ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -162.54 72.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.564 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.966 ' HB3' HG13 ' B' ' 74' ' ' ILE . . . -113.05 90.53 3.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.543 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.661 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 21.5 m-20 -90.92 26.96 1.94 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.1 0.476 . . . . 0.0 110.334 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.74 ' HG3' ' H ' ' B' ' 14' ' ' SER . 13.7 ttp -111.2 170.63 7.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.89 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.842 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 40.8 t -53.84 128.57 30.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.664 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 20.1 mt-10 -37.63 -68.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.896 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -46.51 -27.7 1.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.827 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.842 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -73.88 -45.77 48.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.976 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.691 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -62.18 -30.03 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . 0.555 ' HG2' ' HD3' ' B' ' 4' ' ' ARG . 74.5 mt-30 -77.84 -41.59 36.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.052 0.453 . . . . 0.0 109.908 179.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.47 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -69.24 -29.26 67.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.712 179.177 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.829 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 13.9 t -68.72 -48.7 63.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.184 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.852 HG12 ' HB1' ' B' ' 6' ' ' ALA . 74.2 t -57.58 -43.8 83.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.404 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.5 -35.35 77.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.806 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 90.9 m -71.35 -35.22 71.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.738 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.959 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -71.61 -32.25 67.8 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 90.9 m -72.1 -42.23 66.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.372 -1.286 . . . . 0.0 109.663 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.579 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -52.72 -46.42 67.38 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.241 178.811 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.84 ' HB3' ' HA ' ' B' ' 38' ' ' ILE . . . -64.76 -38.18 90.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.887 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.773 HD13 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -64.07 -33.23 75.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.617 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -78.71 -32.09 46.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.764 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 5.8 mmtt -85.54 -19.91 30.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.654 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.524 ' HE1' ' ND1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -165.98 164.37 18.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.776 179.677 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -124.55 27.99 6.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.756 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.814 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.7 mm -104.5 107.86 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.938 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.75 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 0.9 OUTLIER -30.31 -70.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.411 ' H ' ' HG2' ' B' ' 36' ' ' LYS . 1.8 mmmt -44.71 -49.26 10.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.814 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.4 OUTLIER -55.89 -61.02 2.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 179.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.84 ' HA ' ' HB3' ' B' ' 28' ' ' ALA . 2.5 mt -46.22 -56.86 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.931 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.863 ' HB1' ' HB2' ' A' ' 65' ' ' TYR . . . -44.83 -46.69 10.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.606 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.763 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -65.24 -65.49 0.67 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.436 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.588 ' NE2' ' OE2' ' B' ' 45' ' ' GLU . 1.8 t60 -37.09 -34.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.76 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.86 HG21 HD11 ' B' ' 85' ' ' LEU . 39.5 mt -73.46 -66.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.938 179.758 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.857 ' HG2' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -48.5 -24.02 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.503 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.503 ' N ' ' HD3' ' B' ' 43' ' ' LYS . 2.7 tttm -74.89 -58.38 3.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.793 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.769 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 4.1 mt-10 -62.84 -30.67 71.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.68 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.829 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -69.88 -43.29 72.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.836 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.797 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -63.22 -36.99 85.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.129 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -89.94 -24.07 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.714 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.769 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.46 -13.19 35.32 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.402 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.57 ' HD1' ' O ' ' B' ' 46' ' ' PHE . 2.6 m-85 -126.75 -71.59 0.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.461 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 3.7 m-20 162.02 113.8 0.01 OUTLIER Pre-proline 0 N--CA 1.453 -0.309 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.797 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 44.7 Cg_exo -35.63 148.25 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.523 2.149 . . . . 0.0 112.7 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.702 ' O ' ' HB3' ' B' ' 87' ' ' LYS . 2.1 m -123.98 136.73 54.49 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.102 0.561 . . . . 0.0 110.258 -0.145 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.784 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 62.5 m95 -103.03 129.0 49.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.211 0.529 . . . . 0.0 112.254 -178.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.82 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 7.8 m-70 -112.33 115.88 29.46 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.777 ' HB3' ' CD1' ' B' ' 85' ' ' LEU . 0.0 OUTLIER -134.32 170.32 15.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.693 0.758 . . . . 0.0 112.687 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.938 HD12 HD23 ' A' ' 84' ' ' LEU . 43.8 mt -149.54 165.94 3.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.341 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.847 HG13 ' N ' ' B' ' 39' ' ' ALA . 2.4 p -161.06 116.02 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 0.0 111.13 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.716 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.38 -113.04 1.22 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.234 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.818 ' CZ ' ' HB3' ' A' ' 61' ' ' ASN . 0.0 OUTLIER 174.59 -4.6 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 120.579 0.228 . . . . 0.0 111.59 -179.594 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -170.86 34.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.434 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' B' ' 63' ' ' GLY . 9.5 p90 -99.84 -169.61 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.092 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.654 ' HA3' ' N ' ' A' ' 36' ' ' LYS . . . -147.5 96.69 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.742 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.887 ' HA ' HD12 ' A' ' 57' ' ' ILE . 8.8 p -81.46 149.15 28.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.141 0.496 . . . . 0.0 111.78 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.989 ' HB2' ' HB3' ' A' ' 39' ' ' ALA . 15.9 t80 -152.2 69.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.147 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.84 HG12 HD11 ' A' ' 57' ' ' ILE . 10.2 m -114.68 150.25 16.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.322 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.576 HG21 ' CG2' ' A' ' 53' ' ' THR . 5.2 t -77.26 119.49 20.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.082 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.683 ' H ' ' ND1' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -83.72 148.05 27.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.71 179.807 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.739 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.88 -105.44 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.163 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.599 ' CG2' ' HB2' ' B' ' 87' ' ' LYS . 0.2 OUTLIER -37.54 -101.58 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.479 -179.728 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.601 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 2.9 mmtp -80.81 55.91 2.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.789 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.723 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 9.5 m80 30.99 -89.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.894 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.769 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 0.2 OUTLIER 165.18 -179.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.519 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.966 HG13 ' HB3' ' B' ' 11' ' ' ALA . 1.1 tt -151.83 115.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.703 ' HE2' ' HG ' ' B' ' 64' ' ' SER . 0.9 OUTLIER -111.39 92.76 4.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.812 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.974 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.2 p90 -111.04 168.85 9.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.627 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 49.1 t80 -130.64 112.98 13.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.618 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.035 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -69.16 170.36 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.75 -48.74 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.781 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.501 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 0.7 OUTLIER -145.95 37.57 1.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.862 0.363 . . . . 0.0 110.987 179.814 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.753 HG13 ' H ' ' B' ' 82' ' ' ALA . 69.5 t -154.68 169.08 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.01 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.753 ' H ' HG13 ' B' ' 81' ' ' VAL . . . -128.6 157.74 40.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.664 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.959 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -145.07 117.12 2.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.979 0.419 . . . . 0.0 111.548 -179.702 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.747 HD13 ' HB2' ' B' ' 64' ' ' SER . 0.1 OUTLIER -106.74 92.29 4.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.177 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.86 HD11 HG21 ' B' ' 42' ' ' ILE . 0.2 OUTLIER -96.3 143.74 27.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.529 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.719 ' CD2' HG23 ' B' ' 66' ' ' VAL . 2.4 p90 179.17 136.97 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.729 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.784 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -103.74 162.88 12.72 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.647 179.506 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.82 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.4 OUTLIER -119.52 21.02 12.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.797 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.495 -179.954 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LYS . . . . . 0.606 ' O ' HD12 ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.867 0.365 . . . . 0.0 110.645 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 1.064 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.11 -165.48 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.398 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.75 HG11 ' HE2' ' A' ' 9' ' ' LYS . 79.4 t -155.21 73.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ILE . . . . . 0.972 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.52 158.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.191 0.52 . . . . 0.0 110.77 -179.515 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.765 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 6.9 mmtt -156.87 -11.91 0.09 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.1 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASN . . . . . 0.501 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.1 OUTLIER -169.39 87.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.502 -179.817 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.993 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -123.61 95.77 4.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.836 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.776 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 8.4 m-20 -84.78 36.49 0.61 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.275 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.846 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 14.2 ttp -125.19 164.41 20.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.051 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.629 ' H ' ' HG3' ' A' ' 13' ' ' MET . 52.8 p -55.81 123.89 15.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.833 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 8.8 mt-10 -29.35 -68.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.351 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -44.38 -41.83 6.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' MET . . . . . 0.788 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -65.69 -31.02 71.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.143 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.833 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -71.74 -34.54 69.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.023 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLN . . . . . 0.543 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -75.27 -40.45 58.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.198 0.523 . . . . 0.0 110.043 179.603 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.37 -26.27 62.72 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.825 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.828 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 35.1 t -71.34 -43.74 66.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.197 179.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.792 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 40.5 t -61.01 -46.2 97.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.354 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 64.9 mt-10 -57.68 -43.11 84.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.312 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.559 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 3.3 m -64.21 -36.62 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.199 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.995 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -69.83 -33.47 72.34 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.67 ' HA ' HD11 ' A' ' 29' ' ' LEU . 24.0 m -68.86 -38.09 79.5 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.154 -1.384 . . . . 0.0 109.675 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.752 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 21.7 mm100 -60.34 -40.67 91.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.98 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.94 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -69.28 -33.58 73.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.743 179.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.772 HD11 ' O ' ' A' ' 25' ' ' ALA . 1.2 mt -67.94 -45.93 72.9 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -26.5 65.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.714 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.752 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 5.9 mttp -88.75 -25.72 22.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.844 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.523 ' HE1' ' CB ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -160.07 140.66 11.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.584 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -103.57 30.15 5.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 0.0 110.946 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.972 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.9 mm -112.5 104.81 17.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.112 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.948 ' HA ' HD13 ' A' ' 38' ' ' ILE . 13.2 mp0 -24.34 -79.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.2 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.64 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.2 OUTLIER -40.19 -48.07 2.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.766 179.737 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.972 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -56.8 -54.66 43.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.793 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 1.008 HG23 HD11 ' A' ' 42' ' ' ILE . 2.8 mt -50.46 -48.82 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.86 ' N ' HG11 ' A' ' 58' ' ' VAL . . . -55.46 -61.98 1.98 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.846 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.809 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -39.81 -59.67 1.13 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.806 ' CD2' ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -49.45 -51.54 34.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.206 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 1.008 HD11 HG23 ' A' ' 38' ' ' ILE . 8.2 mt -54.04 -65.31 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.225 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.735 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 22.6 tttm -46.86 -69.47 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.066 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 44' ' ' LYS . 15.3 mmtt -33.18 -59.0 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.969 -179.774 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.732 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 3.8 tp10 -65.08 -30.67 71.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.706 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.828 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -79.1 -7.48 58.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.244 -179.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.816 ' HB3' ' HB3' ' A' ' 52' ' ' PRO . 7.0 m-20 -101.45 -29.07 12.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.158 0.504 . . . . 0.0 110.04 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.579 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -93.76 -23.38 18.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.867 179.805 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.732 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -89.48 -17.27 28.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.217 -179.676 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.755 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 4.2 m-85 -137.91 -64.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.338 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.755 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 0.1 OUTLIER 157.24 119.05 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.113 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.754 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.816 ' HB3' ' HB3' ' A' ' 47' ' ' ASP . 39.5 Cg_endo -66.07 170.47 11.71 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 122.56 2.174 . . . . 0.0 112.465 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.751 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 0.3 OUTLIER -104.4 132.39 50.7 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.834 0.453 . . . . 0.0 110.634 -0.147 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' TRP . . . . . 0.761 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 42.7 m95 -99.78 92.46 5.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.298 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' HIS . . . . . 0.778 ' HB3' HG13 ' B' ' 66' ' ' VAL . 2.4 m170 -62.12 88.85 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.771 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 0.7 OUTLIER -103.66 131.08 51.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.306 -178.232 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 1.032 HD12 ' HA ' ' B' ' 64' ' ' SER . 19.3 mm -123.7 100.31 7.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.566 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . 0.86 HG11 ' N ' ' A' ' 39' ' ' ALA . 3.0 p -98.71 118.43 45.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.845 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -138.72 -128.66 2.6 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.847 -0.692 . . . . 0.0 111.902 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.538 ' HE ' ' HB3' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -165.75 -1.59 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.762 0.315 . . . . 0.0 111.051 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASN . . . . . 0.595 HD21 ' HE ' ' B' ' 60' ' ' ARG . 16.8 t30 174.72 35.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.924 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.81 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 6.7 p90 -87.08 166.56 14.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.051 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.863 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -116.35 84.32 0.36 Allowed Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.896 ' HB2' HD22 ' A' ' 84' ' ' LEU . 90.0 p -80.84 125.19 29.78 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.105 0.479 . . . . 0.0 111.947 -178.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.982 ' HB2' ' HB3' ' B' ' 39' ' ' ALA . 36.5 t80 -131.42 66.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.708 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.735 ' CG1' ' HB3' ' B' ' 55' ' ' HIS . 3.0 m -99.8 172.67 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.266 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.669 HG21 HG23 ' B' ' 53' ' ' THR . 15.5 m -111.02 72.98 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.703 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' HIS . . . . . 0.509 ' NE2' ' OD2' ' A' ' 12' ' ' ASP . 24.1 p-80 -56.44 -164.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.205 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.462 ' N ' ' CD2' ' A' ' 68' ' ' HIS . 11.4 pt-20 168.37 -153.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.667 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.474 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER 51.88 -99.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.769 ' O ' ' HA ' ' A' ' 13' ' ' MET . 3.0 pttt 173.67 20.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.79 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.846 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 62.7 m-70 -121.78 43.72 2.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.757 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . 0.776 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 3.7 t80 -116.06 110.7 19.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.499 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.993 HG13 ' HB1' ' A' ' 11' ' ' ALA . 1.3 tt -123.65 127.12 73.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.317 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ASN . 58.6 t80 -120.96 110.12 15.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.451 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.972 ' HB3' HG13 ' A' ' 8' ' ' ILE . 2.2 p90 -135.68 173.89 11.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.24 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.712 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 28.4 t80 -127.23 113.95 17.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.052 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 1.064 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -78.4 -178.3 5.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.684 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . 0.626 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -60.42 90.82 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.074 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLN . . . . . 0.712 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 31.6 mt-30 78.19 21.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.865 0.364 . . . . 0.0 110.622 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' VAL . . . . . 0.685 HG13 ' O ' ' A' ' 59' ' ' GLY . 90.0 t -151.2 171.54 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.881 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ALA . . . . . 0.672 ' N ' HG11 ' A' ' 81' ' ' VAL . . . -147.95 153.61 39.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.013 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.692 HD13 HG21 ' A' ' 58' ' ' VAL . 0.3 OUTLIER -136.29 127.29 42.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.134 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.896 HD22 ' HB2' ' A' ' 64' ' ' SER . 4.1 tp -111.69 86.6 2.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.651 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.706 HD12 ' CB ' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -93.34 125.99 38.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 -179.67 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.757 ' HB3' ' CD1' ' A' ' 73' ' ' PHE . 7.5 p90 -166.72 134.74 2.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . 0.751 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.99 -162.16 0.88 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.648 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' SER . . . . . 0.45 ' HA ' ' OE2' ' A' ' 69' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.176 0.512 . . . . 0.0 110.981 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' ARG . . . . . 0.641 ' O ' HG11 ' B' ' 22' ' ' VAL . 6.6 mmt85 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.83 0.348 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' LYS . . . . . 0.437 ' HZ3' ' HG2' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 62.07 -174.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.894 179.798 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' ALA . . . . . 1.003 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 71.77 170.11 0.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.447 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' VAL . . . . . 0.603 ' N ' ' O ' ' B' ' 77' ' ' TYR . 89.6 t -134.65 66.96 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.369 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' ILE . . . . . 0.754 ' HA ' ' O ' ' B' ' 75' ' ' TYR . 0.8 OUTLIER -28.95 140.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.917 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' B' ' 7' ' ' VAL . 5.7 mmtt -132.13 -0.36 3.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.628 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' B' ' 9' ' ' LYS . 0.1 OUTLIER 171.56 87.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.733 -179.914 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.904 ' HB1' HG13 ' B' ' 74' ' ' ILE . . . -119.4 89.86 3.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.57 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' ASP . . . . . 0.625 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -91.02 30.05 1.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.459 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' MET . . . . . 0.675 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -117.7 168.42 10.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.761 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' SER . . . . . 0.849 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 0.4 OUTLIER -43.02 141.63 1.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.977 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' GLU . . . . . 0.749 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -52.49 -58.28 7.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.674 179.718 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' GLU . . . . . 0.747 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -57.79 -26.3 61.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.51 179.624 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' MET . . . . . 0.849 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -74.27 -44.3 53.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' GLN . . . . . 0.749 ' OE1' ' HA ' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -65.46 -37.29 86.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.603 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -75.32 -41.06 57.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.635 179.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' ASP . . . . . 0.822 ' HB3' ' HH ' ' B' ' 50' ' ' TYR . 0.4 OUTLIER -69.81 -27.96 65.32 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.482 178.839 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' SER . . . . . 0.776 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -67.37 -47.35 70.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.091 179.173 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.993 HG12 ' HB2' ' B' ' 6' ' ' ALA . 73.9 t -58.22 -48.65 84.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.438 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -56.1 -39.32 71.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.404 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' CYS . . . . . 0.531 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -65.61 -36.02 82.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.985 0.421 . . . . 0.0 110.045 179.319 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.73 ' HB2' HG23 ' B' ' 83' ' ' ILE . . . -68.81 -35.68 77.3 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.856 ' HA ' HD13 ' B' ' 29' ' ' LEU . 4.1 m -65.45 -44.25 87.81 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.744 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' GLN . . . . . 0.734 ' O ' ' HD2' ' B' ' 31' ' ' LYS . 10.6 mm100 -51.99 -49.32 63.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.686 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' ALA . . . . . 0.826 ' HB2' HG21 ' B' ' 38' ' ' ILE . . . -75.42 -16.13 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.605 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . 0.946 HD12 ' HG ' ' B' ' 78' ' ' LEU . 5.2 mt -82.12 -33.8 29.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.246 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -85.11 -33.66 22.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.386 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . 0.734 ' HD2' ' O ' ' B' ' 27' ' ' GLN . 0.1 OUTLIER -78.68 -29.25 45.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.952 0.406 . . . . 0.0 110.548 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' TYR . . . . . 0.63 ' CD1' ' N ' ' B' ' 32' ' ' TYR . 0.0 OUTLIER -149.39 151.65 34.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.64 179.789 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -115.29 30.54 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.957 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' ILE . . . . . 0.955 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.1 mm -109.29 106.83 21.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' GLU . . . . . 0.863 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.0 mm-40 -31.6 -70.21 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.9 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' LYS . . . . . 0.489 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 5.2 mtmm -45.91 -61.05 1.9 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.873 0.368 . . . . 0.0 110.594 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' ASP . . . . . 0.955 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.1 m-20 -44.68 -63.6 0.87 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.765 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . 0.826 HG21 ' HB2' ' B' ' 28' ' ' ALA . 4.4 mt -43.63 -57.28 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.141 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' ALA . . . . . 0.982 ' HB3' ' HB2' ' A' ' 65' ' ' TYR . . . -49.14 -41.55 36.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' ALA . . . . . 0.796 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -59.96 -64.49 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.059 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' HIS . . . . . 0.749 ' HD1' ' HB1' ' B' ' 28' ' ' ALA . 0.2 OUTLIER -47.34 -39.37 14.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.99 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' ILE . . . . . 0.6 HG23 HD13 ' B' ' 85' ' ' LEU . 81.9 mt -59.1 -60.98 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.973 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' LYS . . . . . 0.818 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.1 OUTLIER -46.34 -55.58 7.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.893 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' LYS . . . . . 0.584 ' O ' ' HB3' ' B' ' 48' ' ' LYS . 0.1 OUTLIER -53.85 -35.79 61.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 -179.893 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' GLU . . . . . 0.749 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 5.2 mm-40 -74.43 -40.32 62.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.368 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' PHE . . . . . 0.776 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.77 -35.03 72.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 110.715 179.99 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' ASP . . . . . 0.774 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.9 m-20 -74.18 -31.47 62.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.0 109.91 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' LYS . . . . . 0.584 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -90.0 -24.17 21.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.663 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' LYS . . . . . 0.749 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.24 -30.41 17.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' TYR . . . . . 0.822 ' HH ' ' HB3' ' B' ' 20' ' ' ASP . 28.4 m-85 -123.85 -59.55 1.51 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.599 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' ASN . . . . . 0.503 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER 155.32 118.92 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.097 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.093 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' PRO . . . . . 0.774 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 18.1 Cg_endo -58.15 167.97 4.07 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.44 2.094 . . . . 0.0 112.502 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' THR . . . . . 0.669 HG23 HG21 ' A' ' 67' ' ' THR . 11.3 t -110.71 120.03 41.06 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.749 0.42 . . . . 0.0 110.653 0.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' TRP . . . . . 0.824 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 27.6 m95 -92.7 117.01 29.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.918 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' HIS . . . . . 0.735 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 0.4 OUTLIER -85.15 91.33 8.1 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.928 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' CYS . . . . . 0.818 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 5.7 p -101.8 150.5 23.09 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -177.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' ILE . . . . . 0.885 HG13 HD22 ' B' ' 84' ' ' LEU . 13.3 mm -130.56 159.34 42.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.883 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' VAL . . . . . 0.787 HG11 ' HB1' ' B' ' 39' ' ' ALA . 2.3 p -162.03 108.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.89 0.376 . . . . 0.0 111.046 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' GLY . . . . . 0.728 ' O ' HG12 ' B' ' 81' ' ' VAL . . . -129.21 -133.93 3.7 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.953 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' ARG . . . . . 0.595 ' HE ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -165.83 -9.17 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.707 0.289 . . . . 0.0 111.36 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' ASN . . . . . 0.538 ' HB3' ' HE ' ' A' ' 60' ' ' ARG . 0.6 OUTLIER -170.54 34.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.367 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.891 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 17.5 p90 -103.05 -168.61 1.54 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 0.0 110.682 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' GLY . . . . . 0.837 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -143.33 106.12 0.41 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.041 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 1.032 ' HA ' HD12 ' A' ' 57' ' ' ILE . 63.1 p -89.81 134.93 33.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.082 0.467 . . . . 0.0 111.47 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' TYR . . . . . 0.809 ' CE2' ' HA ' ' A' ' 40' ' ' ALA . 56.3 t80 -144.96 79.34 1.59 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.997 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.878 HG11 HD11 ' A' ' 57' ' ' ILE . 4.9 m -131.51 166.75 27.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.565 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' THR . . . . . 0.448 HG21 HG23 ' A' ' 53' ' ' THR . 1.6 t -79.32 170.11 17.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.584 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' HIS . . . . . 0.808 ' HB3' ' CD2' ' B' ' 73' ' ' PHE . 2.4 p-80 -129.85 154.9 46.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' GLU . . . . . 0.739 ' HG3' ' HG ' ' B' ' 88' ' ' SER . 0.0 OUTLIER -143.32 170.41 15.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.815 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' THR . . . . . 0.478 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 44.49 -95.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.122 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' LYS . . . . . 0.617 ' O ' ' HB2' ' B' ' 13' ' ' MET . 7.1 mmtt -92.17 35.05 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.098 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' HIS . . . . . 0.747 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 13.5 m-70 51.08 -85.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.084 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . 0.808 ' CD2' ' HB3' ' B' ' 68' ' ' HIS . 0.3 OUTLIER 165.52 -166.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.706 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.904 HG13 ' HB1' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -162.22 124.38 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.99 0.424 . . . . 0.0 111.666 179.529 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' TYR . . . . . 0.754 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 0.5 OUTLIER -113.82 146.38 40.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.92 178.87 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . 0.803 ' HE1' HG23 ' B' ' 74' ' ' ILE . 1.4 p90 -170.33 149.15 3.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.849 0.357 . . . . 0.0 111.184 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' TYR . . . . . 0.603 ' O ' ' N ' ' B' ' 7' ' ' VAL . 1.3 t80 -113.99 112.03 22.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.83 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' LEU . . . . . 1.003 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -69.18 169.67 11.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.555 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' GLY . . . . . 0.49 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.53 -42.64 0.02 OUTLIER Glycine 0 CA--C 1.518 0.232 0 C-N-CA 121.088 -0.577 . . . . 0.0 112.89 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' GLN . . . . . 0.712 HE21 ' HA ' ' B' ' 80' ' ' GLN . 0.0 OUTLIER -153.55 40.1 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.971 0.415 . . . . 0.0 110.618 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' VAL . . . . . 0.884 HG12 ' H ' ' B' ' 82' ' ' ALA . 77.9 t -156.4 168.46 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.055 -179.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' ALA . . . . . 0.884 ' H ' HG12 ' B' ' 81' ' ' VAL . . . -128.58 157.48 41.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.578 179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . 0.783 HD11 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -148.57 132.02 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 0.0 111.831 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' LEU . . . . . 0.885 HD22 HG13 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -125.19 101.32 6.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.257 179.332 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' LEU . . . . . 0.773 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 3.6 mp -101.1 133.73 45.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.12 -179.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' PHE . . . . . 0.685 ' CE1' ' HB2' ' B' ' 55' ' ' HIS . 3.2 p90 -172.68 122.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.421 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' LYS . . . . . 0.824 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -104.75 168.34 9.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.658 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' SER . . . . . 0.739 ' HG ' ' HG3' ' B' ' 69' ' ' GLU . 4.3 m -122.15 19.45 10.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.319 0.58 . . . . 0.0 110.815 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.437 -1.202 . . . . 0.0 112.546 -179.968 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.809 0.338 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.15 129.73 36.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.974 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.572 ' OD2' ' HB3' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -85.99 -135.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.827 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.665 ' HA ' HG11 ' A' ' 22' ' ' VAL . 1.1 ttt180 51.71 11.4 0.13 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.752 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 17.6 tptp -74.76 43.09 0.18 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.051 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.052 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -110.23 -172.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.954 0.407 . . . . 0.0 111.263 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.544 HG12 ' HE2' ' A' ' 9' ' ' LYS . 95.6 t -140.04 77.35 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.747 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.803 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -42.85 149.86 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.064 0.459 . . . . 0.0 110.839 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.544 ' HE2' HG12 ' A' ' 7' ' ' VAL . 2.4 mmtt -137.71 -13.85 1.46 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.329 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -176.32 112.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.45 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.785 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -131.71 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 0.0 111.682 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.692 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -137.87 25.86 2.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.694 179.326 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.786 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 25.7 ttp -117.08 166.44 12.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.723 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.984 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 74.4 m -51.92 135.93 29.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.715 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.7 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -41.81 -77.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.742 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.636 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.7 OUTLIER -45.95 -19.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.474 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.984 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.16 -42.22 26.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.45 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.785 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -69.27 -28.37 66.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.492 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.682 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 2.2 pt20 -75.78 -45.79 34.26 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.682 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 2.1 m-20 -67.11 -30.82 70.95 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.76 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.786 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 29.0 t -65.08 -47.61 76.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.922 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.805 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 56.4 t -57.85 -48.09 84.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.799 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.613 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 52.3 mt-10 -60.74 -38.3 84.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.353 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.63 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 57.1 m -66.41 -34.08 77.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.193 0.521 . . . . 0.0 109.668 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.746 ' HB2' HG22 ' A' ' 83' ' ' ILE . . . -70.21 -39.9 74.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.382 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.999 ' HA ' HD12 ' A' ' 29' ' ' LEU . 55.2 m -66.09 -38.88 89.35 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.958 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.578 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 7.6 mm-40 -58.19 -41.59 84.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.806 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.989 ' HB2' ' HB3' ' A' ' 41' ' ' HIS . . . -70.97 -29.14 65.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.794 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.999 HD12 ' HA ' ' A' ' 26' ' ' THR . 1.0 OUTLIER -72.05 -41.92 66.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.026 179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.21 -36.55 77.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.184 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.506 ' HD3' ' CE1' ' A' ' 41' ' ' HIS . 2.1 mttp -79.73 -25.72 41.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.738 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.573 ' CE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.43 143.34 18.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -108.61 30.3 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.901 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.902 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 8.0 mm -110.53 111.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.849 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.724 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 8.5 mp0 -28.47 -82.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.823 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.526 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -37.19 -48.62 0.86 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.551 179.519 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.902 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.6 t70 -53.09 -63.53 1.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.76 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 5.3 mt -46.32 -47.06 6.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.805 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.795 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -56.53 -50.71 71.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.001 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.801 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -57.59 -55.46 34.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.775 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.989 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 1.2 t60 -47.1 -46.92 23.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.564 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.987 HG22 HD11 ' A' ' 85' ' ' LEU . 49.6 mt -61.1 -71.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.754 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 1.1 tmtt? -42.64 -40.56 2.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.151 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.468 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 24.3 tptt -55.57 -62.28 1.79 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.171 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.628 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp0 -62.76 -49.83 73.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.786 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -55.18 -35.67 65.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.26 -179.687 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.754 ' HB2' ' HE2' ' A' ' 43' ' ' LYS . 0.8 OUTLIER -72.02 -38.06 69.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.108 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.08 9.23 43.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.106 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.628 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -128.92 5.17 5.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.164 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.779 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 63.9 m-85 -144.61 -66.75 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.035 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.779 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 5.6 p30 162.57 109.18 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.187 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.687 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 77.0 Cg_exo -47.77 149.44 5.18 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 122.432 2.088 . . . . 0.0 112.477 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.784 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 11.0 t -119.51 135.82 54.61 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.056 0.542 . . . . 0.0 110.657 -0.214 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.778 ' CH2' ' HE2' ' A' ' 17' ' ' MET . 47.4 m95 -96.67 124.61 40.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 111.741 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.716 ' HB3' ' CB ' ' B' ' 66' ' ' VAL . 0.0 OUTLIER -107.94 101.98 11.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.726 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.796 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 1.9 p -116.86 152.17 35.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.265 0.555 . . . . 0.0 112.425 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.985 HD11 HG12 ' B' ' 66' ' ' VAL . 20.8 mm -130.36 110.96 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.379 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.764 HG11 ' N ' ' A' ' 39' ' ' ALA . 3.4 p -105.18 121.23 56.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.38 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.664 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -162.42 176.35 38.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.144 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.672 ' HB3' ' HA ' ' A' ' 81' ' ' VAL . 0.1 OUTLIER -138.07 40.97 2.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.651 0.262 . . . . 0.0 111.297 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.693 ' O ' ' HG2' ' B' ' 60' ' ' ARG . 2.5 t-20 168.61 25.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.885 0.374 . . . . 0.0 111.208 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.947 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 15.1 p90 -109.34 -166.95 1.15 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.609 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.833 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -150.71 102.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.047 -0.597 . . . . 0.0 111.97 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.984 ' HB2' HD21 ' A' ' 84' ' ' LEU . 88.4 p -86.11 134.57 33.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.096 0.474 . . . . 0.0 111.584 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.694 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 60.1 t80 -149.83 87.49 1.49 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.057 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.878 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 11.5 m -132.66 168.1 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.216 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.674 HG23 ' OG1' ' B' ' 53' ' ' THR . 13.2 t -92.14 83.23 5.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.561 ' C ' ' HG2' ' A' ' 69' ' ' GLU . 32.2 p-80 -55.68 -179.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.49 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.561 ' HG2' ' C ' ' A' ' 68' ' ' HIS . 0.7 OUTLIER 176.38 -166.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.918 0.39 . . . . 0.0 111.228 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.739 HG23 ' HA3' ' A' ' 89' ' ' GLY . 0.2 OUTLIER 58.86 -100.23 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.836 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' A' ' 13' ' ' MET . 1.3 mtmp? 179.15 28.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.991 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.786 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 3.7 m-70 -138.27 54.12 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.348 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.815 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.1 t80 -125.04 89.93 3.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.186 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.875 HG22 ' HE1' ' A' ' 76' ' ' PHE . 1.2 tt -109.55 142.44 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 111.673 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.627 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 21.6 t80 -130.96 131.55 44.49 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.063 179.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.875 ' HE1' HG22 ' A' ' 74' ' ' ILE . 1.2 p90 -154.85 179.27 9.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.152 -179.408 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.742 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 24.4 t80 -137.91 104.15 5.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.698 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.052 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.3 mm? -58.86 173.74 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.083 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.456 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.15 -44.59 0.17 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.039 -0.6 . . . . 0.0 112.872 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.67 ' O ' ' HG3' ' A' ' 80' ' ' GLN . 9.6 tp-100 -144.8 25.58 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.609 0.242 . . . . 0.0 111.323 -179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.684 HG13 ' H ' ' A' ' 82' ' ' ALA . 13.9 t -146.79 178.04 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.841 0.353 . . . . 0.0 111.111 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.775 ' O ' HD11 ' A' ' 83' ' ' ILE . . . -141.11 154.07 45.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.842 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.775 HD11 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -139.26 137.26 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.154 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.984 HD21 ' HB2' ' A' ' 64' ' ' SER . 3.0 tp -121.89 81.81 1.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.573 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.987 HD11 HG22 ' A' ' 42' ' ' ILE . 0.4 OUTLIER -85.87 126.66 34.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.329 -179.616 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.815 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -168.7 125.0 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.497 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.784 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -98.59 -171.27 2.09 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.631 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.547 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 0.5 OUTLIER -125.97 20.17 7.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.238 0.542 . . . . 0.0 110.641 179.919 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.739 ' HA3' HG23 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.251 1.166 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.47 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.819 0.342 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -147.83 63.4 1.12 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.036 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 34.5 t0 53.93 -113.27 0.77 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.695 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.633 ' HD2' ' HA ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER 53.03 72.07 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.129 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.478 ' C ' HD11 ' B' ' 78' ' ' LEU . 5.9 tppt? -93.51 47.21 1.23 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.091 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.022 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.32 -175.5 3.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.301 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.554 HG13 ' HE3' ' B' ' 9' ' ' LYS . 69.3 t -141.2 74.03 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.774 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.758 ' HA ' ' HB3' ' B' ' 76' ' ' PHE . 1.1 mp -34.1 157.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.074 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.738 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 6.1 mmpt? -146.4 -15.08 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.936 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.514 HD21 ' HA ' ' B' ' 10' ' ' ASN . 0.1 OUTLIER 179.81 102.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.486 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.769 ' HB3' ' NE2' ' B' ' 18' ' ' GLN . . . -130.52 104.54 7.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.899 0.381 . . . . 0.0 111.935 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.604 ' N ' ' O ' ' B' ' 73' ' ' PHE . 4.4 t70 -89.21 30.6 0.95 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.154 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.842 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 28.4 ttp -120.96 156.06 32.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.909 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.741 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.8 OUTLIER -46.98 135.78 9.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.59 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.729 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 10.6 mm-40 -41.36 -69.7 0.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.226 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.576 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 18.0 mm-40 -44.99 -37.97 4.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.891 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.799 ' HE1' ' CE2' ' B' ' 50' ' ' TYR . 0.0 OUTLIER -65.64 -33.23 75.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.61 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.869 ' HB3' HD11 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.37 -29.48 63.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.103 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.633 ' HA ' ' HD2' ' B' ' 4' ' ' ARG . 6.7 pt20 -75.9 -41.74 51.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 0.0 110.382 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.478 ' O ' ' SG ' ' B' ' 24' ' ' CYS . 0.5 OUTLIER -73.41 -28.83 62.21 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.887 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 1.8 t -67.6 -44.27 78.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.184 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.882 HG11 ' HB3' ' B' ' 6' ' ' ALA . 47.2 t -63.26 -48.51 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.766 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.663 ' HA ' ' HG1' ' B' ' 26' ' ' THR . 85.8 mt-10 -55.06 -41.5 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.562 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.478 ' SG ' ' O ' ' B' ' 20' ' ' ASP . 75.5 m -64.39 -37.76 88.64 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.368 179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.88 ' HB1' HD11 ' B' ' 83' ' ' ILE . . . -67.9 -28.22 67.32 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.663 ' HG1' ' HA ' ' B' ' 23' ' ' GLU . 3.0 m -71.67 -43.22 66.4 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.77 178.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.417 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 1.2 mt-30 -53.13 -46.62 68.86 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.619 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.651 ' O ' ' HD1' ' B' ' 32' ' ' TYR . . . -77.22 -20.26 55.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.291 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.72 HD13 ' C ' ' B' ' 25' ' ' ALA . 6.3 mt -77.19 -32.96 56.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.11 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -89.42 -27.45 20.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.371 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.729 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 41.9 mmtm -83.47 -29.32 28.11 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.917 0.389 . . . . 0.0 110.705 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.729 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -152.68 141.09 20.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.566 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.71 29.39 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.955 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 1.007 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 7.5 mm -103.61 101.28 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.868 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.833 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.9 mp0 -29.83 -68.85 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.637 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -49.48 -56.2 10.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.818 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 1.007 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -49.27 -63.67 1.04 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.679 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.755 ' O ' HG13 ' B' ' 42' ' ' ILE . 38.8 mt -42.38 -46.31 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.935 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.685 ' HB3' ' CB ' ' A' ' 65' ' ' TYR . . . -63.65 -40.64 97.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.925 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.694 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -57.67 -67.15 0.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.967 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.605 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -46.66 -57.31 4.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.728 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.755 HG13 ' O ' ' B' ' 38' ' ' ILE . 78.1 mt -43.59 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.653 ' HB3' ' HE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -36.99 -48.09 0.75 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.325 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.451 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -59.38 -45.3 91.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.549 -179.601 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.666 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.7 OUTLIER -69.68 -46.9 65.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.359 -179.519 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.814 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -60.85 -33.0 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.979 -179.823 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.771 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.73 -50.2 26.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.721 179.789 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.932 ' HA ' ' HE3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -72.28 -22.36 61.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.666 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -90.45 -26.57 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.799 ' CE2' ' HE1' ' B' ' 17' ' ' MET . 15.2 m-85 -120.02 -65.35 1.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.192 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.69 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 21.7 t-20 160.27 110.19 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.96 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.771 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 81.2 Cg_exo -43.84 149.79 0.68 Allowed 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 122.49 2.127 . . . . 0.0 112.717 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.674 ' OG1' HG23 ' A' ' 67' ' ' THR . 0.2 OUTLIER -125.75 137.92 53.83 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 122.955 0.502 . . . . 0.0 110.549 -0.104 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.778 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 34.2 m95 -95.28 121.5 37.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.828 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.878 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -91.09 97.91 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.437 178.672 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.867 ' HB3' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -113.72 143.44 44.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 112.448 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.978 HG23 HG22 ' A' ' 57' ' ' ILE . 21.2 mm -130.11 97.21 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.06 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.768 HG23 HD13 ' B' ' 83' ' ' ILE . 3.3 p -98.48 129.69 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.971 0.415 . . . . 0.0 111.385 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.754 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -144.96 -144.03 4.09 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.693 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.63 10.71 0.06 Allowed 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.756 0.312 . . . . 0.0 111.111 -179.659 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.516 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 2.2 t-20 175.98 30.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.933 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.947 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 9.5 p90 -102.13 -166.64 1.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.985 0.422 . . . . 0.0 110.976 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.724 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -147.82 86.76 0.16 Allowed Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.919 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.902 ' HB3' ' HE2' ' B' ' 62' ' ' PHE . 8.3 p -73.28 141.64 47.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.398 . . . . 0.0 111.533 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.801 ' CE2' ' HA ' ' A' ' 40' ' ' ALA . 12.1 t80 -147.08 62.34 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.359 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.985 HG12 HD11 ' A' ' 57' ' ' ILE . 21.5 m -102.38 161.31 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.535 ' O ' ' HG2' ' B' ' 69' ' ' GLU . 18.4 m -99.13 94.5 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.846 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.717 ' HA ' ' HD2' ' B' ' 86' ' ' PHE . 0.0 OUTLIER -31.22 -44.48 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.163 -179.853 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.568 ' HG2' ' O ' ' B' ' 68' ' ' HIS . 19.3 pt-20 43.64 36.83 1.33 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.997 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.651 HG23 ' H ' ' B' ' 71' ' ' LYS . 3.0 m -170.16 -136.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.969 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.654 ' O ' ' HA ' ' B' ' 13' ' ' MET . 10.2 mtmm -146.43 12.47 1.19 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.71 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.842 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 8.4 m-70 -119.41 47.59 1.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.678 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 6.8 t80 -116.47 116.78 28.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.53 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.869 HD11 ' HB3' ' B' ' 18' ' ' GLN . 0.8 OUTLIER -135.85 125.76 41.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.999 0.428 . . . . 0.0 111.729 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.738 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 16.6 t80 -112.07 136.64 51.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.803 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.806 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 2.3 p90 -162.56 164.1 26.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 111.246 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.518 ' O ' ' N ' ' B' ' 7' ' ' VAL . 65.4 t80 -122.52 109.62 14.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.015 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.022 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -70.27 170.37 11.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.629 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.13 -47.03 0.02 OUTLIER Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.191 -0.528 . . . . 0.0 112.932 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.574 ' O ' HG21 ' B' ' 81' ' ' VAL . 2.8 mt-30 -149.56 37.18 0.74 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.905 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.883 HG13 ' H ' ' B' ' 82' ' ' ALA . 85.6 t -154.02 170.84 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.162 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.883 ' H ' HG13 ' B' ' 81' ' ' VAL . . . -137.43 141.72 41.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.88 HD11 ' HB1' ' B' ' 25' ' ' ALA . 0.2 OUTLIER -128.24 128.6 68.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.07 0.462 . . . . 0.0 111.678 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.96 HD22 ' HB ' ' B' ' 57' ' ' ILE . 1.2 tp -116.31 85.3 2.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.031 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.867 HD12 ' HB3' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -93.03 128.94 39.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.573 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.793 ' CD1' HG21 ' B' ' 66' ' ' VAL . 1.2 p90 -167.62 123.7 1.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.849 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.778 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 32.7 mtpt -91.59 159.88 15.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.753 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.631 ' H ' ' CE1' ' B' ' 55' ' ' HIS . 32.2 m -105.17 18.31 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.302 0.572 . . . . 0.0 110.799 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.428 -1.207 . . . . 0.0 112.544 -179.962 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.42 ' HE3' ' HB3' ' A' ' 1' ' ' MET . 5.6 mtp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.837 0.351 . . . . 0.0 111.277 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.41 ' C ' ' CG ' ' A' ' 3' ' ' ASP . 0.4 OUTLIER -133.49 -50.32 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.864 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.41 ' CG ' ' C ' ' A' ' 2' ' ' CYS . 0.0 OUTLIER 175.36 136.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.96 179.954 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.981 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.5 OUTLIER 54.62 24.48 5.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.708 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.64 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 20.7 tptm -79.75 67.19 5.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.177 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.069 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -135.9 -168.95 2.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.8 ' O ' ' HD2' ' A' ' 9' ' ' LYS . 73.6 t -145.67 72.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.932 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 1.079 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -43.92 162.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.251 0.548 . . . . 0.0 111.09 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.8 ' HD2' ' O ' ' A' ' 7' ' ' VAL . 0.0 OUTLIER -149.82 -22.42 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.343 179.095 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.666 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 54.8 t30 -156.5 165.52 36.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.265 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.666 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 166.54 127.97 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.985 0.422 . . . . 0.0 111.911 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.772 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 2.1 m-20 -118.36 26.93 9.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.872 178.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.888 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 28.6 ttp -108.91 167.04 10.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.823 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.678 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.1 OUTLIER -58.14 129.4 41.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.79 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.674 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 mt-10 -33.74 -66.72 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -50.55 -32.92 19.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.785 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.691 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 39.5 mmm -72.63 -33.72 66.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.17 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.802 ' HA ' HD13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.49 -39.41 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.636 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.981 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 1.8 mt-30 -74.48 -34.3 63.08 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.24 -31.79 66.13 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.848 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.742 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -67.34 -46.45 73.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.18 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.76 HG12 ' CD2' ' A' ' 76' ' ' PHE . 11.8 t -59.67 -45.16 94.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.541 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 43.0 mt-10 -59.64 -37.0 77.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.117 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.616 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 11.5 t -66.32 -40.22 89.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.159 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.734 ' HA ' HD12 ' A' ' 42' ' ' ILE . . . -67.49 -22.59 65.45 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.676 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 2.3 m -78.85 -46.39 18.72 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.581 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.558 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 7.4 mm100 -48.06 -45.23 32.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.417 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.919 ' HB2' HG21 ' A' ' 38' ' ' ILE . . . -77.47 -33.84 54.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.127 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.691 ' CD1' ' HG ' ' A' ' 78' ' ' LEU . 5.5 mt -63.75 -24.02 67.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.055 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -99.43 -28.65 13.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.554 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.785 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 29.5 mmtp -84.87 -27.27 26.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 111.091 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.785 ' CE1' ' HB2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -146.25 161.31 40.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -126.31 36.38 4.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.866 HG21 ' HD3' ' A' ' 36' ' ' LYS . 3.3 mm -120.15 97.43 5.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.829 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.66 ' C ' ' HA3' ' B' ' 63' ' ' GLY . 2.5 mp0 -22.5 -72.71 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.206 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.866 ' HD3' HG21 ' A' ' 34' ' ' ILE . 0.0 OUTLIER -47.62 -51.04 22.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.5 179.617 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.855 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.6 t0 -54.38 -62.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.52 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.919 HG21 ' HB2' ' A' ' 28' ' ' ALA . 5.6 mt -43.51 -42.82 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.874 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.686 ' HB1' ' HB2' ' B' ' 65' ' ' TYR . . . -65.6 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.902 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.809 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -39.1 -51.39 1.88 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.938 0.399 . . . . 0.0 110.724 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.591 ' HD1' ' HB1' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -64.91 -54.91 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.89 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.832 HD11 HG22 ' A' ' 38' ' ' ILE . 83.9 mt -45.72 -56.42 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.098 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.516 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -59.47 -70.9 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.966 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.537 ' HD2' ' C ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -34.1 -59.97 0.41 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.959 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -46.76 84.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.941 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.742 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -59.76 -18.58 44.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.817 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.72 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -87.84 -34.27 18.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.636 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -99.56 6.72 45.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.755 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.97 6.68 8.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.102 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.598 ' CD1' ' HE3' ' A' ' 17' ' ' MET . 95.2 m-85 -149.1 -67.3 0.22 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.738 ' O ' ' HE2' ' A' ' 87' ' ' LYS . 12.3 m-20 160.93 108.52 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.432 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.72 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 92.0 Cg_exo -43.85 155.76 0.19 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.47 2.113 . . . . 0.0 112.437 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.803 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.5 m -117.2 132.61 56.6 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 123.199 0.6 . . . . 0.0 110.485 -0.048 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.818 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 60.6 m95 -98.81 166.89 11.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.415 0.626 . . . . 0.0 111.951 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.87 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.0 OUTLIER -158.03 109.26 2.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.237 179.269 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.783 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 6.2 p -121.96 152.05 40.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.223 0.535 . . . . 0.0 112.425 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.989 HG13 HD11 ' B' ' 57' ' ' ILE . 20.9 mm -129.13 105.93 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.391 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.66 HG11 ' HB ' ' A' ' 38' ' ' ILE . 5.6 p -104.13 124.33 58.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.915 0.388 . . . . 0.0 111.675 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.725 ' O ' HG11 ' A' ' 81' ' ' VAL . . . -149.65 -131.45 1.94 Allowed Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.758 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.613 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -160.02 5.64 0.09 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.657 0.265 . . . . 0.0 111.475 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.613 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 41.8 t30 166.7 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.763 0.315 . . . . 0.0 111.312 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.748 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 45.9 p90 -77.5 -178.33 5.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.0 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.602 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.94 76.94 0.39 Allowed Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.177 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.768 ' HA ' HG12 ' B' ' 57' ' ' ILE . 88.6 p -69.98 151.97 44.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.881 0.372 . . . . 0.0 111.354 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.954 ' HB2' ' HB2' ' B' ' 39' ' ' ALA . 11.6 t80 -164.22 56.81 0.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.589 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.808 HG13 ' CZ ' ' A' ' 86' ' ' PHE . 6.9 m -80.83 -161.12 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.049 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.599 HG21 ' OG1' ' B' ' 53' ' ' THR . 1.2 m -157.03 96.47 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.221 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.628 ' CD2' ' N ' ' A' ' 69' ' ' GLU . 42.6 t60 -175.68 -97.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.846 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.628 ' N ' ' CD2' ' A' ' 68' ' ' HIS . 0.6 OUTLIER 43.75 75.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.973 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -101.99 -37.27 8.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.984 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.772 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 4.3 ptpt -177.67 12.18 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.941 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.911 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 61.6 m-70 -136.97 23.99 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.822 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.833 ' HD2' ' HB3' ' A' ' 86' ' ' PHE . 14.1 t80 -105.63 168.8 8.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.852 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.802 HD13 ' HA ' ' A' ' 18' ' ' GLN . 1.4 tt 171.54 119.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.124 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.403 ' O ' ' HD3' ' A' ' 9' ' ' LYS . 3.5 t80 -116.52 111.33 19.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.809 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 1.079 ' HB3' HG13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -130.98 176.46 8.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.221 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.709 ' CB ' ' HE2' ' A' ' 9' ' ' LYS . 20.2 t80 -135.93 103.97 5.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.756 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.069 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -61.41 177.66 0.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.916 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.83 -42.03 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.46 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.516 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 2.2 pm0 -154.53 43.04 0.5 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.862 0.363 . . . . 0.0 110.829 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.863 HG12 ' N ' ' A' ' 82' ' ' ALA . 55.6 t -154.49 166.85 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.116 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.863 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -134.68 114.48 12.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.673 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.649 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -105.71 120.4 56.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.998 0.428 . . . . 0.0 111.429 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.783 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -105.06 91.78 3.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.316 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.716 HD11 ' CB ' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -95.86 127.11 41.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -179.282 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.833 ' HB3' ' HD2' ' A' ' 73' ' ' PHE . 30.0 p90 -158.06 144.48 17.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.742 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.911 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -105.14 -170.23 1.72 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.957 0.408 . . . . 0.0 110.771 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.87 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -145.16 17.43 1.56 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.471 0.653 . . . . 0.0 109.994 179.533 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.532 ' H ' ' HZ1' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.351 -1.249 . . . . 0.0 112.521 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.547 ' C ' ' H ' ' B' ' 3' ' ' ASP . 5.3 ttt . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.838 0.351 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.51 ' O ' ' HD3' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -67.02 9.92 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.763 179.931 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.547 ' H ' ' C ' ' B' ' 1' ' ' MET . 6.4 t70 61.93 7.72 2.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.817 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.756 ' HG2' ' CD ' ' B' ' 19' ' ' GLN . 0.1 OUTLIER -116.52 66.01 0.71 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.815 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.723 ' O ' HD11 ' B' ' 78' ' ' LEU . 0.0 OUTLIER -80.44 118.67 22.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.029 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 162.1 -167.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.116 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.983 HG12 ' HE2' ' B' ' 9' ' ' LYS . 22.7 t -156.67 73.24 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.968 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -47.24 148.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.06 0.457 . . . . 0.0 110.535 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.983 ' HE2' HG12 ' B' ' 7' ' ' VAL . 2.8 mmtt -154.68 -1.95 0.17 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.324 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.905 ' HB3' ' HB3' ' B' ' 75' ' ' TYR . 0.3 OUTLIER -164.08 70.3 0.2 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.963 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.754 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -110.73 153.81 24.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.133 0.492 . . . . 0.0 111.511 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.605 ' HB3' ' HD2' ' B' ' 68' ' ' HIS . 6.9 t70 -149.85 28.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.015 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.908 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 11.9 ttp -121.48 170.82 9.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.66 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.747 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.3 OUTLIER -57.19 140.86 48.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.716 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.701 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 31.5 mp0 -46.0 -63.39 0.99 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.172 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -28.69 19.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.004 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.908 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 53.4 mmm -79.63 -35.56 39.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.048 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.73 ' HG2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -71.17 -35.67 71.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.921 0.391 . . . . 0.0 110.315 179.657 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.756 ' CD ' ' HG2' ' B' ' 4' ' ' ARG . 2.6 mm-40 -75.16 -36.56 61.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.182 0.515 . . . . 0.0 109.646 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.544 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 5.4 m-20 -70.35 -29.28 65.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.653 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.826 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -68.92 -49.22 59.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.905 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.806 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 77.6 t -54.28 -45.29 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.139 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 83.6 mt-10 -58.94 -39.6 82.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.878 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 13.3 t -65.22 -36.23 83.52 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.009 -0.542 . . . . 0.0 109.968 179.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 1.024 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -69.26 -29.56 67.49 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.802 ' HA ' HD13 ' B' ' 29' ' ' LEU . 2.0 m -71.45 -37.69 71.36 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.825 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.483 ' HB2' ' HE2' ' B' ' 41' ' ' HIS . 43.1 mt-30 -60.72 -42.73 97.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.692 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.94 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -73.42 -27.2 61.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.583 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.802 HD13 ' HA ' ' B' ' 26' ' ' THR . 2.5 mt -72.98 -49.19 30.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.87 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.75 -26.64 63.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.024 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.629 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 2.6 mttp -86.73 -30.32 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.966 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.695 ' HH ' ' HD1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.6 163.91 36.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.005 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.42 27.75 6.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.75 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.682 ' HB ' ' CB ' ' B' ' 37' ' ' ASP . 9.2 mm -108.78 106.39 20.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.797 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.633 ' OE2' ' HA2' ' B' ' 59' ' ' GLY . 2.0 mm-40 -29.78 -71.03 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.502 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -46.82 -48.05 20.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.869 0.366 . . . . 0.0 110.609 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.682 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 14.3 t0 -54.77 -60.81 2.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.648 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.94 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 3.9 mt -48.13 -49.1 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.516 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.954 ' HB2' ' HB2' ' A' ' 65' ' ' TYR . . . -56.6 -35.5 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.43 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.791 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -72.04 -63.64 1.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.317 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.732 ' CD2' ' HB3' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -37.47 -56.13 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.14 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.755 HG12 ' HA ' ' B' ' 25' ' ' ALA . 6.9 mt -56.56 -68.24 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.284 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.638 ' HE3' ' HE2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -38.94 -47.84 1.5 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.827 0.346 . . . . 0.0 111.146 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.508 ' N ' ' HD2' ' B' ' 43' ' ' LYS . 0.4 OUTLIER -61.91 -53.11 60.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.462 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.514 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 1.2 tp10 -60.83 -34.21 74.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.164 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.826 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -67.06 -49.04 66.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.821 0.343 . . . . 0.0 110.606 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.647 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -55.73 -37.66 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.86 -20.2 22.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.383 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.514 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 3.0 tttt -88.5 -13.35 40.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 111.18 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.64 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 23.3 m-85 -142.49 -67.54 0.37 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.418 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.64 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 30.8 t-20 160.22 117.32 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.827 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.647 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 10.7 Cg_endo -53.28 168.96 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.442 2.095 . . . . 0.0 112.511 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.706 HG22 ' O ' ' B' ' 53' ' ' THR . 8.6 t -109.99 122.45 47.61 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 122.833 0.453 . . . . 0.0 110.775 0.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.831 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 48.5 m95 -92.44 120.8 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.704 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.667 ' HE2' HG22 ' B' ' 53' ' ' THR . 0.2 OUTLIER -100.0 105.44 17.11 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.116 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.731 ' CB ' HD11 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -130.8 165.28 23.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.52 0.676 . . . . 0.0 112.183 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.989 HD11 HG13 ' A' ' 57' ' ' ILE . 34.3 mt -146.44 165.41 8.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.589 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.882 ' H ' HG21 ' B' ' 57' ' ' ILE . 1.7 p -155.14 122.35 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 111.596 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.633 ' HA2' ' OE2' ' B' ' 35' ' ' GLU . . . -149.2 -175.02 21.23 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.037 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.65 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.9 OUTLIER -146.3 36.18 1.0 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.218 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.65 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.2 OUTLIER 168.11 26.6 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.121 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.791 ' CE2' ' HB3' ' B' ' 64' ' ' SER . 0.1 OUTLIER -111.48 -166.57 1.09 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.66 ' HA3' ' C ' ' A' ' 35' ' ' GLU . . . -144.8 77.79 0.27 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.843 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.938 ' HA ' HD12 ' A' ' 57' ' ' ILE . 18.1 p -70.6 131.77 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.034 0.445 . . . . 0.0 111.531 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.809 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 55.7 t80 -144.76 76.51 1.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.304 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.951 HG11 HD11 ' A' ' 57' ' ' ILE . 28.5 m -110.2 167.39 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.235 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.509 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 28.7 m -112.8 134.98 54.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.875 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.605 ' HD2' ' HB3' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -87.36 176.63 7.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.834 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.599 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -162.61 56.81 0.22 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.827 -179.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.668 HG23 ' H ' ' B' ' 71' ' ' LYS . 2.0 t 169.37 -108.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.947 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.668 ' H ' HG23 ' B' ' 70' ' ' THR . 0.0 OUTLIER -163.26 28.94 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.606 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.919 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 7.3 m80 -128.75 41.96 3.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.983 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.758 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 12.9 t80 -117.59 83.65 2.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.357 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.787 HD13 HD11 ' B' ' 8' ' ' ILE . 0.0 OUTLIER -110.94 109.5 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.922 -179.155 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.905 ' HB3' ' HB3' ' B' ' 10' ' ' ASN . 14.1 t80 -99.33 126.02 45.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.315 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.968 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.7 p90 -142.92 170.24 16.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.007 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.64 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 50.9 t80 -132.9 116.94 17.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.621 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.029 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -69.13 167.64 15.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.679 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -29.12 -46.9 0.08 OUTLIER Glycine 0 C--N 1.329 0.145 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.945 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.56 ' C ' HG22 ' B' ' 81' ' ' VAL . 2.8 tt0 -143.32 27.63 1.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.61 ' O ' ' N ' ' B' ' 78' ' ' LEU . 38.3 t -145.41 171.03 5.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.894 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.732 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -132.34 145.52 51.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.882 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 1.024 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -142.97 106.42 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.153 -179.741 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.735 ' HG ' ' O ' ' B' ' 84' ' ' LEU . 0.2 OUTLIER -97.97 110.17 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.575 179.741 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.758 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 2.0 mp -106.88 125.21 50.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.9 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.725 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.7 OUTLIER -151.58 119.07 6.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.364 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.919 ' HB2' ' HB2' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -97.01 164.27 12.59 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.758 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.599 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -119.23 18.98 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.341 0.591 . . . . 0.0 110.649 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . 0.491 ' HA2' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.339 -1.256 . . . . 0.0 112.467 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.427 ' O ' ' CG ' ' A' ' 1' ' ' MET . 1.4 ttp . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.879 0.371 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 m -102.82 42.33 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.954 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.9 165.83 12.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.941 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.471 ' HD2' ' HB2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -112.74 78.69 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.022 -179.842 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.713 ' O ' ' HB1' ' A' ' 6' ' ' ALA . 0.3 OUTLIER -64.58 110.21 2.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.75 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.033 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 159.15 172.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.693 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.761 ' O ' ' HE2' ' A' ' 9' ' ' LYS . 8.7 t -131.03 69.37 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.847 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -33.48 149.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.761 ' HE2' ' O ' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -134.84 -12.71 2.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.8 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 177.51 93.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.638 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.822 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -129.72 104.13 7.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.723 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.517 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 16.8 m-20 -96.01 27.71 3.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.234 0.54 . . . . 0.0 109.866 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.99 ' HE2' HG23 ' A' ' 74' ' ' ILE . 0.9 OUTLIER -103.79 168.96 8.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.783 -179.622 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.887 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -51.32 123.59 9.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.466 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -34.86 -69.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.824 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.509 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 32.6 tt0 -52.15 -28.38 17.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.899 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -71.85 -41.6 67.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.856 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.722 ' HA ' HD13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.42 -29.51 69.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.944 0.402 . . . . 0.0 110.331 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.759 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -77.21 -42.32 37.87 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.097 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.759 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -69.29 -28.4 66.25 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.555 178.986 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.801 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 30.0 t -67.11 -51.12 58.07 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.969 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.765 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 94.1 t -54.41 -46.59 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.926 179.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -54.34 -43.62 71.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.351 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -39.27 91.76 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.951 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.847 ' HB2' HG21 ' A' ' 83' ' ' ILE . . . -69.39 -30.97 69.07 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.572 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -70.68 -37.08 73.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.58 178.499 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.448 HE21 ' HB3' ' A' ' 27' ' ' GLN . 6.0 mt-30 -58.81 -42.4 89.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.971 ' HB2' HG23 ' A' ' 38' ' ' ILE . . . -79.84 -23.03 42.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.289 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.83 HD13 ' HG ' ' A' ' 78' ' ' LEU . 4.6 mt -81.1 -26.13 36.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.022 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.23 -32.47 15.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.201 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.511 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -86.08 -24.94 26.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.783 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.628 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -150.11 155.86 40.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.614 179.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -123.54 28.53 6.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.063 0.458 . . . . 0.0 110.735 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.852 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 16.1 mm -106.59 107.54 22.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.942 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.759 ' HB3' ' CA ' ' B' ' 63' ' ' GLY . 0.9 OUTLIER -26.67 -84.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.033 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.01 -47.31 2.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.323 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.852 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -54.75 -63.11 1.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 0.0 111.14 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.971 HG23 ' HB2' ' A' ' 28' ' ' ALA . 3.2 mt -48.2 -48.21 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.901 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -59.86 -42.1 92.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.05 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.787 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.4 -64.67 0.77 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.077 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.611 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -52.29 -39.53 60.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.659 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.719 HD12 ' CG2' ' A' ' 38' ' ' ILE . 85.4 mt -58.56 -57.22 11.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.958 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.578 ' HD2' ' HG1' ' B' ' 67' ' ' THR . 0.2 OUTLIER -51.57 -60.51 3.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -42.57 -62.23 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.602 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.3 mt-10 -42.98 -67.48 0.27 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.946 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.801 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -44.57 -51.32 9.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.729 ' OD1' ' HB2' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -57.54 -25.02 59.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.087 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -120.97 14.27 11.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.18 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.5 tttp -128.44 1.89 5.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.389 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.507 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 72.2 m-85 -152.85 -62.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.185 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.482 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 3.1 m-20 161.24 117.67 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.566 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.579 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 19.1 Cg_endo -60.06 169.18 5.07 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.521 2.147 . . . . 0.0 112.327 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.776 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 88.6 m -104.92 130.58 53.06 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.011 0.525 . . . . 0.0 110.254 -0.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.729 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 69.1 m95 -101.51 170.56 8.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.654 0.74 . . . . 0.0 112.421 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.683 ' HE2' ' N ' ' A' ' 88' ' ' SER . 0.3 OUTLIER -162.92 103.64 1.01 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.442 179.495 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 1.094 ' HB3' HD13 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -117.97 156.12 29.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.538 0.685 . . . . 0.0 112.796 -177.667 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.922 HD13 ' H ' ' B' ' 65' ' ' TYR . 27.0 mm -127.45 157.52 39.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.144 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.776 HG11 ' N ' ' A' ' 39' ' ' ALA . 4.1 p -152.36 112.12 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.888 0.375 . . . . 0.0 111.276 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.608 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -150.75 -155.86 7.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.157 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.474 ' HB2' HH11 ' A' ' 60' ' ' ARG . 0.1 OUTLIER -163.5 34.72 0.09 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 120.76 0.314 . . . . 0.0 111.289 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 171.05 26.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.785 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 24.0 p90 -111.12 179.95 3.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.802 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.854 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -135.4 96.29 0.27 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.321 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 1.028 ' HA ' HD11 ' B' ' 57' ' ' ILE . 4.7 p -82.03 129.82 34.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.061 0.458 . . . . 0.0 111.54 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.791 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 67.3 t80 -143.49 84.18 1.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.118 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.921 HG13 HD13 ' B' ' 57' ' ' ILE . 4.4 m -135.81 159.85 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.306 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.806 HG21 ' CE1' ' B' ' 55' ' ' HIS . 1.3 t -66.75 -171.98 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.034 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.623 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -129.05 172.69 11.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.011 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.725 ' CG ' ' HA ' ' A' ' 88' ' ' SER . 7.1 mm-40 -163.85 143.85 8.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.885 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.736 HG22 ' HG2' ' A' ' 71' ' ' LYS . 48.3 m 47.64 -102.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.861 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 19.6 mmtt -74.06 32.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.742 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.74 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 53.7 m-70 48.77 -87.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.74 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 2.3 p90 163.51 156.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.786 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.99 HG23 ' HE2' ' A' ' 13' ' ' MET . 0.7 OUTLIER -127.96 106.21 14.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 111.024 179.566 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.744 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 63.4 t80 -106.72 93.82 4.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.847 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -107.69 168.59 9.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.331 -179.534 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.64 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 76.7 t80 -127.0 87.39 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.716 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.033 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -40.67 167.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.465 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.38 -48.58 0.33 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.759 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.25 20.6 2.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.632 HG13 ' N ' ' A' ' 82' ' ' ALA . 39.9 t -140.7 175.12 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.708 ' O ' ' HA ' ' A' ' 58' ' ' VAL . . . -137.14 143.45 42.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.661 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.847 HG21 ' HB2' ' A' ' 25' ' ' ALA . 0.2 OUTLIER -132.45 111.49 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 -179.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.904 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 3.9 tp -94.93 88.81 5.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.417 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 1.094 HD13 ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -93.65 141.0 28.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.458 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.656 ' CB ' ' HB2' ' A' ' 73' ' ' PHE . 2.8 p90 -176.51 152.23 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.861 ' HZ3' ' HG2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -112.43 -168.46 1.32 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.841 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.725 ' HA ' ' CG ' ' A' ' 69' ' ' GLU . 41.8 m -145.21 18.26 1.56 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.297 0.57 . . . . 0.0 110.517 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.37 -1.239 . . . . 0.0 112.434 -179.974 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.493 ' HB3' ' H ' ' B' ' 2' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.87 0.367 . . . . 0.0 111.045 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.537 ' O ' ' HB2' ' B' ' 3' ' ' ASP . 0.5 OUTLIER -63.04 -19.26 64.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.833 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.652 ' HB3' ' CD ' ' B' ' 23' ' ' GLU . 16.2 m-20 80.26 173.65 0.13 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.91 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.437 ' NH1' ' HB2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER 63.78 -79.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.764 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.8 OUTLIER 46.08 31.01 1.04 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.002 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.002 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.79 -177.94 4.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.27 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.638 HG11 ' HE2' ' B' ' 9' ' ' LYS . 72.9 t -141.85 68.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.553 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.901 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -38.58 150.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 -179.725 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.638 ' HE2' HG11 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -137.92 -15.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.991 179.497 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.5 OUTLIER -175.92 122.73 0.19 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.417 -179.864 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.665 ' HB3' HG13 ' B' ' 74' ' ' ILE . . . -149.03 102.08 3.22 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.788 0.328 . . . . 0.0 111.821 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.705 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -84.62 26.79 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.291 0.567 . . . . 0.0 109.857 178.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.865 ' HG2' ' N ' ' B' ' 14' ' ' SER . 0.1 OUTLIER -114.66 166.76 11.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.544 -179.586 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.865 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.3 OUTLIER -55.33 141.37 36.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.744 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.644 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -51.58 -56.59 12.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -28.73 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.686 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.74 ' HA ' ' OD2' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -75.56 -39.51 58.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.851 179.85 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.769 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -66.42 -29.25 69.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.052 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -77.55 -45.15 26.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.095 0.474 . . . . 0.0 109.818 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.74 ' OD2' ' HA ' ' B' ' 17' ' ' MET . 2.2 p30 -70.97 -27.72 63.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.741 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.888 ' HG ' HG22 ' B' ' 74' ' ' ILE . 96.2 p -68.88 -44.27 73.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.232 179.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.812 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 40.6 t -62.67 -47.32 93.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.564 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.652 ' CD ' ' HB3' ' B' ' 3' ' ' ASP . 3.6 mm-40 -58.73 -35.05 72.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.69 -37.24 79.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.006 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.892 ' HB1' HG23 ' B' ' 83' ' ' ILE . . . -70.08 -31.14 68.57 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.683 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 23.8 m -71.0 -42.34 69.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.295 -1.321 . . . . 0.0 109.505 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.519 ' O ' ' HG3' ' B' ' 30' ' ' GLU . 1.7 mt-30 -51.97 -46.44 64.8 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.316 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.768 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -77.24 -19.83 56.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.172 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.739 HD11 ' C ' ' B' ' 25' ' ' ALA . 5.2 mt -78.71 -25.22 44.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.938 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 1.2 pt-20 -90.28 -38.39 13.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.172 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.838 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.2 mmtp -77.52 -33.48 54.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.614 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.838 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -143.4 146.38 33.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.812 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.585 ' OD1' HD11 ' B' ' 34' ' ' ILE . 26.2 p30 -113.52 30.22 7.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.899 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 14.6 mm -106.78 105.98 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.676 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.854 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.3 mp0 -29.52 -67.48 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.74 ' HZ1' ' HB2' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -52.71 -56.96 11.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.886 0.374 . . . . 0.0 110.719 179.625 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.899 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.7 t0 -45.55 -65.43 0.54 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.743 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.768 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 8.2 mt -43.76 -58.94 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.114 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.868 ' HB3' HG12 ' B' ' 58' ' ' VAL . . . -45.96 -52.83 11.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.952 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.791 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -47.84 -66.11 0.46 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.967 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.558 ' CE1' ' CD1' ' B' ' 32' ' ' TYR . 0.2 OUTLIER -45.86 -43.64 13.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.942 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.705 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 67.1 mt -54.85 -62.84 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.788 ' HD3' ' CE2' ' A' ' 65' ' ' TYR . 12.0 tttm -50.48 -37.28 37.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.752 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.73 ' HZ2' ' HB3' ' B' ' 44' ' ' LYS . 0.3 OUTLIER -64.2 -46.99 81.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.093 -179.811 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.704 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 26.3 tt0 -73.25 -28.83 62.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.778 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -77.49 -36.17 52.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.741 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 4.0 m-20 -74.92 -30.49 61.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.098 0.475 . . . . 0.0 110.221 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -87.08 -40.78 14.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.753 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.704 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.9 ttmt -76.6 -27.34 55.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 -179.553 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.658 ' CD2' ' HE3' ' B' ' 17' ' ' MET . 16.7 m-85 -121.02 -68.52 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.339 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.497 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER 155.86 119.47 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 -179.523 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.741 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 19.7 Cg_endo -58.53 168.31 4.16 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 122.375 2.05 . . . . 0.0 112.645 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.705 HG21 ' HE2' ' B' ' 55' ' ' HIS . 15.1 t -106.91 133.16 51.99 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.229 0.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.878 ' NE1' ' HE3' ' B' ' 87' ' ' LYS . 39.5 m95 -103.86 110.14 22.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.418 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.806 ' CE1' HG21 ' A' ' 67' ' ' THR . 3.5 m170 -82.57 95.62 7.82 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.558 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 24.5 p -110.43 133.93 52.81 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.019 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 1.028 HD11 ' HA ' ' A' ' 64' ' ' SER . 17.6 mm -125.15 115.23 43.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.704 178.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.868 HG12 ' HB3' ' B' ' 39' ' ' ALA . 2.5 p -116.87 119.13 61.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.024 0.44 . . . . 0.0 111.691 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.771 ' O ' HG12 ' B' ' 81' ' ' VAL . . . -137.17 -125.98 2.47 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.809 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.417 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.7 OUTLIER -165.15 -6.1 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.671 0.272 . . . . 0.0 111.464 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.429 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 14.2 t-20 179.26 37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.856 0.36 . . . . 0.0 111.077 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.785 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.4 p90 -88.62 179.85 6.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.759 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -125.28 74.98 0.4 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.981 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.977 ' HB2' HD23 ' B' ' 84' ' ' LEU . 65.4 p -71.26 135.26 47.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.965 0.412 . . . . 0.0 111.514 -179.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.922 ' H ' HD13 ' A' ' 57' ' ' ILE . 18.4 t80 -146.83 71.16 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.458 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.89 HG11 HD12 ' A' ' 57' ' ' ILE . 17.9 m -104.59 163.73 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.097 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.578 ' HG1' ' HD2' ' A' ' 43' ' ' LYS . 20.0 m -103.02 103.94 14.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.15 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.546 ' HD2' ' CB ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -70.74 -158.36 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.545 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.4 OUTLIER 177.33 -87.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.056 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.479 ' O ' ' O ' ' B' ' 69' ' ' GLU . 2.0 m -37.97 -99.2 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.281 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.589 ' NZ ' ' HB3' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 179.16 44.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.903 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.704 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 36.6 m80 -135.48 42.52 2.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.877 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.705 ' HD1' ' H ' ' B' ' 12' ' ' ASP . 2.7 t80 -113.6 106.83 14.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.419 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.888 HG22 ' HG ' ' B' ' 21' ' ' SER . 0.7 OUTLIER -121.81 144.83 29.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.641 -179.797 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.807 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -133.95 133.35 41.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.006 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.901 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.08 163.55 36.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.577 -179.344 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.675 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 11.5 t80 -120.79 105.25 10.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.737 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.002 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.3 mm? -69.86 170.77 10.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.605 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.73 -35.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.898 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.599 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -159.54 43.41 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.787 0.327 . . . . 0.0 110.854 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.894 HG13 HD13 ' B' ' 83' ' ' ILE . 54.2 t -158.92 167.1 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.235 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.637 ' H ' HG12 ' B' ' 81' ' ' VAL . . . -140.8 101.14 4.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.707 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.894 HD13 HG13 ' B' ' 81' ' ' VAL . 0.3 OUTLIER -84.61 150.06 4.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.374 -179.64 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.977 HD23 ' HB2' ' B' ' 64' ' ' SER . 1.6 tp -135.64 84.88 2.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.757 HD22 ' CE2' ' B' ' 46' ' ' PHE . 0.4 OUTLIER -87.91 137.46 32.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 110.948 179.816 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.718 ' CD2' HG23 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -171.64 124.23 0.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.897 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.878 ' HE3' ' NE1' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -96.62 149.35 21.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.794 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -109.97 20.41 17.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.302 0.572 . . . . 0.0 110.566 179.809 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.429 -1.206 . . . . 0.0 112.508 -179.987 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.768 0.318 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.54 ' O ' ' HG2' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -122.78 77.41 1.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.95 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 42.09 32.31 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.061 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.54 ' HG2' ' O ' ' A' ' 2' ' ' CYS . 1.9 mtm180 -86.03 -49.75 7.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.715 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.445 ' O ' HD11 ' A' ' 78' ' ' LEU . 0.7 OUTLIER 33.54 31.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.378 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.1 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.18 -169.61 2.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.217 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.663 HG11 ' HE3' ' A' ' 9' ' ' LYS . 15.1 t -147.89 72.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.87 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.79 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.9 135.82 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.029 0.442 . . . . 0.0 110.355 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.663 ' HE3' HG11 ' A' ' 7' ' ' VAL . 8.5 mmpt? -113.59 -18.59 11.89 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.544 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.663 ' O ' ' HB1' ' A' ' 11' ' ' ALA . 0.7 OUTLIER -176.06 158.62 2.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.682 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.767 ' HB2' ' HA ' ' A' ' 74' ' ' ILE . . . 169.03 138.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.998 0.427 . . . . 0.0 111.685 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.786 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER -123.65 28.96 6.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.464 179.461 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.721 ' HG3' ' H ' ' A' ' 14' ' ' SER . 15.8 ttp -104.44 170.44 7.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.842 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.721 ' H ' ' HG3' ' A' ' 13' ' ' MET . 22.7 t -56.41 129.35 40.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.699 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.633 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.0 mm-40 -36.72 -67.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.47 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -48.58 -29.51 4.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.802 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.64 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.54 -31.91 62.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.791 179.799 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.682 ' NE2' ' HB3' ' A' ' 13' ' ' MET . 0.0 OUTLIER -72.83 -39.07 66.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.586 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.596 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 93.0 mt-30 -77.46 -34.09 54.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.763 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.47 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.0 OUTLIER -71.49 -36.25 71.07 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.603 179.12 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.817 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 1.2 p -64.34 -50.15 68.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.942 179.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.725 HG23 HD12 ' A' ' 8' ' ' ILE . 16.4 t -54.98 -45.15 76.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.338 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.659 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 11.8 mt-10 -56.07 -41.05 74.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.35 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.63 -39.44 93.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.141 0.496 . . . . 0.0 110.027 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.742 ' C ' HD13 ' A' ' 29' ' ' LEU . . . -69.22 -30.89 69.15 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.532 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -70.75 -36.95 73.37 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.498 178.543 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.669 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 22.2 mt-30 -59.52 -41.62 90.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.478 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.911 ' HB3' ' HA ' ' A' ' 38' ' ' ILE . . . -83.04 -22.57 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.688 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.742 HD13 ' C ' ' A' ' 25' ' ' ALA . 4.3 mt -76.28 -36.13 58.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.992 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.08 -29.65 19.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.837 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.669 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 20.6 mttt -83.63 -20.84 32.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.627 ' CG ' ' HE1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -146.31 -172.52 3.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.586 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.09 27.48 0.36 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.103 0.478 . . . . 0.0 110.542 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 1.046 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 18.9 mm -114.57 104.64 17.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.772 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.628 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 3.5 mp0 -25.39 -77.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.393 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.497 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -46.17 -45.14 16.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.193 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 1.046 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -57.97 -60.14 4.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.936 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.911 ' HA ' ' HB3' ' A' ' 28' ' ' ALA . 4.3 mt -51.75 -54.78 11.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.985 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.799 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -53.78 -39.38 65.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.043 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.736 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.9 -63.12 1.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.123 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.627 ' HE1' ' CG ' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -54.76 -49.03 71.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.822 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.864 HG22 HD12 ' A' ' 85' ' ' LEU . 73.3 mt -44.39 -58.85 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.091 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.728 ' HE3' ' CE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -60.26 -61.61 2.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.682 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.555 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 10.6 mttt -36.71 -66.31 0.23 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.004 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.731 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mm-40 -49.16 -42.6 40.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.91 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.817 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -61.9 -42.71 99.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.165 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.733 ' HA ' ' CD1' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -65.55 -24.11 67.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.845 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.92 8.92 16.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.461 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.731 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 7.4 tttm -118.17 -1.52 11.35 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.716 ' CE1' ' HB3' ' A' ' 49' ' ' LYS . 10.9 m-85 -150.52 -62.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.363 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.68 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 17.3 t-20 164.82 115.46 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.291 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.728 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 18.9 Cg_endo -60.03 168.82 5.45 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.339 2.026 . . . . 0.0 112.593 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.786 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.9 m -101.82 137.34 40.25 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 110.3 0.032 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.824 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 76.5 m95 -106.12 140.42 39.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.517 0.675 . . . . 0.0 112.039 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.837 ' HE2' ' HB2' ' A' ' 88' ' ' SER . 0.4 OUTLIER -132.18 107.82 8.86 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.923 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.887 ' HB3' HD11 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -127.87 175.08 8.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.388 0.614 . . . . 0.0 112.198 -177.922 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.935 HG12 ' HA ' ' B' ' 64' ' ' SER . 60.8 mt -155.39 165.1 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.713 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.828 ' H ' HG21 ' A' ' 57' ' ' ILE . 7.5 p -151.55 119.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.942 0.401 . . . . 0.0 110.984 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.483 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -143.91 -174.49 16.22 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.113 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.789 ' HG3' HH11 ' A' ' 60' ' ' ARG . 0.4 OUTLIER -150.88 30.06 0.65 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.825 0.345 . . . . 0.0 111.014 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.694 ' ND2' ' NH1' ' B' ' 60' ' ' ARG . 0.7 OUTLIER 172.14 27.5 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.789 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -111.07 -168.21 1.27 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.738 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -142.13 78.59 0.28 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.855 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.97 ' HA ' HD13 ' B' ' 57' ' ' ILE . 5.8 p -72.23 128.54 35.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.992 0.425 . . . . 0.0 111.231 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.816 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 33.0 t80 -143.45 83.59 1.78 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.415 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.99 HG11 ' HB3' ' B' ' 55' ' ' HIS . 2.9 m -127.42 155.85 38.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.453 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.699 HG21 ' HE2' ' B' ' 55' ' ' HIS . 1.2 t -63.75 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.488 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.783 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -148.02 112.76 5.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.847 0.356 . . . . 0.0 111.198 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.734 ' CB ' ' HA ' ' A' ' 88' ' ' SER . 38.9 mm-40 -97.43 174.08 6.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.747 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.572 ' C ' ' H ' ' A' ' 72' ' ' HIS . 0.2 OUTLIER 38.02 -119.19 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.688 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.506 ' H ' ' HB ' ' A' ' 70' ' ' THR . 3.1 mttt -71.16 30.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.904 0.383 . . . . 0.0 110.832 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.786 ' CG ' ' HB3' ' A' ' 12' ' ' ASP . 15.5 m-70 68.91 -88.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.008 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.793 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 162.55 -163.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.752 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.767 ' HA ' ' HB2' ' A' ' 11' ' ' ALA . 0.2 OUTLIER -169.64 111.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.617 179.515 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.445 ' CE1' ' OG ' ' A' ' 64' ' ' SER . 40.0 t80 -105.38 129.21 53.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.309 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.79 ' HB3' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -141.77 178.73 7.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.203 -179.849 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.839 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 5.3 t80 -140.18 102.75 4.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.1 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -67.88 -176.0 0.62 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.922 0.391 . . . . 0.0 111.043 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.555 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -55.82 88.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.278 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.618 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 2.5 mp0 80.07 10.64 1.23 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.777 0.322 . . . . 0.0 110.863 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.758 HG12 ' H ' ' A' ' 82' ' ' ALA . 4.4 t -136.22 177.49 6.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.248 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.839 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -148.55 159.7 43.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.752 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -146.21 117.23 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.915 0.388 . . . . 0.0 111.707 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.855 HD22 ' HE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -99.64 100.02 10.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.301 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.887 HD11 ' HB3' ' A' ' 56' ' ' CYS . 0.5 OUTLIER -103.2 130.98 50.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.855 ' HE2' HD22 ' A' ' 84' ' ' LEU . 34.3 p90 -166.89 131.79 2.08 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.773 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.824 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 34.6 mtpt -86.2 -163.2 0.85 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.837 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.837 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 2.8 m -147.72 17.44 1.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.372 0.606 . . . . 0.0 110.366 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.401 ' N ' ' OG1' ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.353 -1.249 . . . . 0.0 112.531 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.0 tpt . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.699 0.285 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.457 ' SG ' ' HB3' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -155.53 125.2 6.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.909 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.594 ' O ' ' HG2' ' B' ' 23' ' ' GLU . 0.1 OUTLIER -104.79 142.99 33.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.661 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.828 ' N ' ' HD2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -112.84 -21.96 10.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.912 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.619 ' HA ' ' CE ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 42.61 28.06 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.599 -179.822 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.094 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.15 -164.71 1.35 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.932 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.536 HG22 ' O ' ' B' ' 77' ' ' TYR . 14.7 t -151.5 75.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.126 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.91 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -40.11 156.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.59 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.601 ' N ' HG21 ' B' ' 8' ' ' ILE . 0.0 OUTLIER -151.9 -8.84 0.21 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.526 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.559 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 0.1 OUTLIER -164.58 73.59 0.24 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.459 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.756 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -118.04 113.37 21.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.485 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.688 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 1.4 m-20 -114.29 32.58 5.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.379 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.877 ' HG2' ' N ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -116.65 170.02 8.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.677 -179.68 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.877 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -49.32 129.59 18.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.597 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 47.8 mt-10 -38.32 -70.43 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.035 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -48.64 -31.99 7.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.902 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.866 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -69.97 -38.59 76.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.882 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -67.31 -38.43 84.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.746 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.736 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 7.3 mm-40 -73.92 -35.83 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.772 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.598 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.5 OUTLIER -72.46 -30.81 64.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.806 179.189 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.846 ' HG ' HD13 ' B' ' 74' ' ' ILE . 0.4 OUTLIER -68.61 -42.36 78.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.294 179.487 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.8 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 12.5 t -66.95 -38.04 80.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.438 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.736 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 18.8 mt-10 -63.78 -39.11 93.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.081 179.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 73.0 m -68.72 -34.25 75.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.915 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.875 ' HB1' HG21 ' B' ' 83' ' ' ILE . . . -73.14 -33.77 65.69 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 1.046 ' HA ' HD12 ' B' ' 29' ' ' LEU . 53.8 m -70.53 -38.43 74.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.296 178.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . . . . . . . . . 10.7 mt-30 -58.52 -42.06 86.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.356 178.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.907 ' HB3' HG22 ' B' ' 38' ' ' ILE . . . -67.67 -35.85 79.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.133 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 1.046 HD12 ' HA ' ' B' ' 26' ' ' THR . 1.1 mt -64.1 -38.86 92.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -30.62 59.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.175 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.523 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 1.0 OUTLIER -82.93 -29.48 29.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.875 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.598 ' HH ' ' HD1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.75 169.04 21.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.629 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.669 ' C ' HD12 ' B' ' 34' ' ' ILE . 11.3 t30 -129.09 30.51 5.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.124 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 1.02 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.8 mm -116.73 106.29 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.961 ' HA ' HD11 ' B' ' 38' ' ' ILE . 1.1 mp0 -29.61 -70.35 0.05 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.769 0.318 . . . . 0.0 110.667 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.12 -43.95 7.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.589 179.421 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 1.02 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -64.06 -59.56 4.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.451 179.634 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 1.006 ' HB ' HG13 ' B' ' 58' ' ' VAL . 1.0 OUTLIER -45.35 -53.74 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.665 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.754 ' HB3' ' HB2' ' A' ' 65' ' ' TYR . . . -49.83 -49.11 50.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.816 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -53.86 -68.23 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.807 ' CG ' ' HB2' ' B' ' 28' ' ' ALA . 0.2 OUTLIER -37.59 -40.92 0.43 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.45 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.76 HG12 ' HA ' ' B' ' 25' ' ' ALA . 56.9 mt -68.15 -67.66 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.555 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.679 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 6.0 tttp -39.87 -53.42 2.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.267 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.616 ' HE2' ' OH ' ' A' ' 65' ' ' TYR . 23.7 mttm -60.33 -43.98 95.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.415 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.769 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 50.0 tp10 -62.12 -37.2 84.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.296 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.782 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.36 -34.95 73.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.118 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.702 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.3 OUTLIER -68.73 -35.49 77.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.807 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.58 -23.52 21.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.138 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.769 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.97 -26.43 21.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.659 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 1.4 m-85 -127.94 -62.45 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.171 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.669 HD21 ' N ' ' B' ' 51' ' ' ASN . 0.0 OUTLIER 154.96 117.12 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.828 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.702 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 10.8 Cg_endo -53.92 169.45 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 122.351 2.034 . . . . 0.0 112.191 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.622 ' CG2' ' HB ' ' A' ' 67' ' ' THR . 5.8 m -111.37 124.92 53.24 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 122.866 0.467 . . . . 0.0 110.705 0.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.679 ' O ' ' HD2' ' B' ' 43' ' ' LYS . 33.6 m95 -97.53 146.75 24.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.723 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.99 ' HB3' HG11 ' A' ' 66' ' ' VAL . 10.5 m170 -111.07 98.79 7.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.108 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.792 ' SG ' HD12 ' B' ' 85' ' ' LEU . 43.6 t -103.58 124.05 48.08 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -177.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.97 HD13 ' HA ' ' A' ' 64' ' ' SER . 21.2 mm -121.92 102.54 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.127 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 1.006 HG13 ' HB ' ' B' ' 38' ' ' ILE . 2.6 p -107.24 121.87 60.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.678 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.743 ' O ' ' HB3' ' B' ' 60' ' ' ARG . . . -146.64 -97.24 0.2 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.05 -0.595 . . . . 0.0 111.773 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.756 ' HA ' ' HB1' ' B' ' 82' ' ' ALA . 7.8 ptt180 167.59 -27.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -158.6 46.69 0.32 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.667 0.27 . . . . 0.0 111.407 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.789 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 14.8 p90 -96.37 175.41 6.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.659 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.628 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -117.0 83.94 0.36 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.947 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.935 ' HA ' HG12 ' A' ' 57' ' ' ILE . 0.3 OUTLIER -75.73 133.12 40.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 111.432 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.882 ' H ' HG12 ' A' ' 57' ' ' ILE . 22.4 t80 -142.45 61.08 1.44 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.199 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.765 ' HB ' ' CZ ' ' B' ' 86' ' ' PHE . 33.2 m -108.6 168.65 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.678 -179.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.593 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 81.8 m -130.72 107.7 9.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.93 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.8 ' CE1' ' HG3' ' B' ' 87' ' ' LYS . 2.3 t-80 -63.92 -143.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.701 ' H ' ' ND1' ' B' ' 68' ' ' HIS . 0.0 OUTLIER 171.21 15.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.668 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.65 ' HB ' ' CE1' ' B' ' 68' ' ' HIS . 98.0 m -141.97 -96.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.082 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.808 ' HG2' ' HG3' ' B' ' 13' ' ' MET . 0.0 OUTLIER -87.31 14.69 7.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.268 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.692 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 47.7 m80 76.99 -78.84 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.699 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 12.4 p90 156.5 -169.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.34 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.882 HG13 ' HB3' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -157.35 114.11 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.021 0.439 . . . . 0.0 111.617 179.804 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.608 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 0.1 OUTLIER -102.27 137.24 40.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.236 179.435 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.91 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.4 OUTLIER -160.64 159.22 30.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.916 0.389 . . . . 0.0 111.307 -179.821 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.592 ' HB3' ' HE3' ' B' ' 9' ' ' LYS . 7.8 t80 -125.07 112.59 16.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.094 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -71.65 170.5 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.489 179.553 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.523 ' O ' ' HG3' ' B' ' 80' ' ' GLN . . . -24.44 -40.18 0.01 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 121.211 -0.518 . . . . 0.0 113.037 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' B' ' 78' ' ' LEU . 27.2 mt-30 -157.56 40.1 0.29 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.867 0.365 . . . . 0.0 110.803 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.742 HG12 ' O ' ' B' ' 59' ' ' GLY . 98.6 t -154.73 169.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.123 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.763 ' O ' HD12 ' B' ' 83' ' ' ILE . . . -132.36 151.96 51.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.331 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.875 HG21 ' HB1' ' B' ' 25' ' ' ALA . 0.2 OUTLIER -140.09 134.55 36.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.076 0.465 . . . . 0.0 111.589 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.717 HD21 HG12 ' B' ' 57' ' ' ILE . 0.3 OUTLIER -123.84 97.61 5.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.108 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.792 HD12 ' SG ' ' B' ' 56' ' ' CYS . 0.5 OUTLIER -100.85 131.62 46.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.975 0.417 . . . . 0.0 111.541 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.765 ' CZ ' ' HB ' ' B' ' 66' ' ' VAL . 0.4 OUTLIER -172.34 123.97 0.49 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.586 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.8 ' HG3' ' CE1' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -82.29 161.82 22.5 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.779 0.323 . . . . 0.0 110.721 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.696 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -107.57 19.12 20.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.231 0.538 . . . . 0.0 110.767 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . 0.473 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.427 -1.207 . . . . 0.0 112.412 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.648 ' HG3' ' H ' ' A' ' 2' ' ' CYS . 3.5 tpt . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.877 0.37 . . . . 0.0 111.244 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.648 ' H ' ' HG3' ' A' ' 1' ' ' MET . 0.7 OUTLIER 32.5 -147.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.04 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 5' ' ' LYS . 2.3 p30 -163.33 -156.75 0.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.81 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.74 ' HB3' ' NE2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -54.33 84.59 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.991 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.537 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -115.72 50.96 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.838 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.122 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.5 173.9 9.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.369 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.716 HG11 ' HE3' ' A' ' 9' ' ' LYS . 47.9 t -123.92 71.49 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.726 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.865 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -41.37 162.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.077 -179.745 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.716 ' HE3' HG11 ' A' ' 7' ' ' VAL . 2.5 mmtt -155.12 -11.3 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -176.22 94.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.616 -179.859 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.894 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.32 84.95 2.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.637 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.703 ' H ' ' HD1' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -73.79 34.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.01 0.433 . . . . 0.0 110.407 179.4 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.793 ' HG3' ' H ' ' A' ' 14' ' ' SER . 12.1 ttp -127.69 170.4 12.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.948 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.793 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.3 OUTLIER -61.91 128.8 37.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.837 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.713 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -34.07 -78.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.15 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.419 ' OE1' ' HG2' ' A' ' 17' ' ' MET . 0.0 OUTLIER -37.21 -35.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.993 -179.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.72 ' HE2' ' CE2' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -70.87 -41.6 71.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.166 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.84 ' NE2' ' HB2' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -66.91 -35.33 79.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.74 ' NE2' ' HB3' ' A' ' 4' ' ' ARG . 4.1 mm100 -73.99 -37.92 64.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.139 0.495 . . . . 0.0 109.812 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.468 ' HB3' ' HH ' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -74.25 -31.02 62.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.022 179.372 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.769 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -67.8 -40.77 83.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.242 179.308 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.862 HG11 ' HB2' ' A' ' 6' ' ' ALA . 64.0 t -65.52 -50.8 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.59 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 13.3 mt-10 -53.61 -38.79 64.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -37.13 76.59 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.791 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.893 ' HA ' HD12 ' A' ' 42' ' ' ILE . . . -68.09 -25.12 65.16 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.114 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.718 ' HA ' HD11 ' A' ' 29' ' ' LEU . 4.2 m -74.93 -45.31 43.29 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.043 -1.435 . . . . 0.0 109.784 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.762 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 53.8 mt-30 -51.82 -47.37 64.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.85 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.706 ' HB2' ' HA ' ' A' ' 38' ' ' ILE . . . -74.42 -26.36 60.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.199 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.785 HD13 ' HG ' ' A' ' 78' ' ' LEU . 6.6 mt -67.15 -43.58 81.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.14 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.403 ' OE1' ' HG2' ' A' ' 1' ' ' MET . 16.3 mt-10 -94.13 -10.84 31.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.12 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.762 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 3.7 mttp -85.01 -21.75 29.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 110.588 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.734 ' CE1' ' HB3' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -148.57 -54.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.452 179.374 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.54 ' HA ' HD13 ' A' ' 38' ' ' ILE . 1.8 t30 80.38 26.78 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.385 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.798 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -111.69 91.03 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.851 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.667 ' HG2' ' HA2' ' A' ' 59' ' ' GLY . 3.1 mp0 -14.05 -85.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 O-C-N 123.603 0.564 . . . . 0.0 111.685 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.49 -49.97 2.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.816 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.798 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -57.6 -60.1 4.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.641 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.706 ' HA ' ' HB2' ' A' ' 28' ' ' ALA . 51.7 mt -44.43 -51.86 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.91 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.729 ' HB1' HG12 ' A' ' 58' ' ' VAL . . . -55.9 -38.9 70.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.005 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.764 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -60.41 -66.36 0.54 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.868 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.583 ' HD1' ' HB2' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -50.86 -49.68 58.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.893 HD12 ' HA ' ' A' ' 25' ' ' ALA . 94.2 mt -50.24 -52.83 13.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.032 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.904 ' HE3' ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -61.75 -70.2 0.2 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.762 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -30.99 -50.31 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' A' ' 49' ' ' LYS . 3.6 mt-10 -63.84 -67.1 0.46 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.795 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.769 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -40.16 -39.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.783 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.761 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 9.8 t70 -68.29 -42.57 79.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.027 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -99.0 9.54 43.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.166 -179.789 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.56 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -117.32 -23.58 7.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.124 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.761 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 84.4 m-85 -120.79 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.272 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.761 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 13.7 t30 162.68 111.81 0.01 OUTLIER Pre-proline 0 N--CA 1.454 -0.245 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.094 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.761 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 81.8 Cg_exo -44.92 156.39 0.25 Allowed 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.372 2.048 . . . . 0.0 112.378 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.678 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 6.8 m -112.46 138.64 48.92 Favored 'General case' 0 C--N 1.345 0.41 0 C-N-CA 123.037 0.535 . . . . 0.0 110.511 -0.046 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.814 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 70.8 m95 -108.43 140.87 41.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.446 0.641 . . . . 0.0 112.488 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.881 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.1 OUTLIER -135.13 104.41 5.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.836 178.631 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.906 ' SG ' HD11 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -120.91 165.64 14.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.557 0.694 . . . . 0.0 112.79 -177.676 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.895 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 17.4 mm -132.51 165.21 32.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.601 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.752 ' H ' HG22 ' A' ' 57' ' ' ILE . 2.6 p -162.47 108.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.918 0.39 . . . . 0.0 111.541 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.734 ' O ' ' HB3' ' A' ' 60' ' ' ARG . . . -141.83 -114.62 1.08 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.734 ' HB3' ' O ' ' A' ' 59' ' ' GLY . 0.7 OUTLIER 166.68 -12.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.636 0.255 . . . . 0.0 111.657 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -157.78 40.27 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.672 0.272 . . . . 0.0 111.128 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 1.043 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -106.69 -169.5 1.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.951 0.405 . . . . 0.0 111.021 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.875 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.59 86.4 0.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.873 ' HB2' HD12 ' B' ' 57' ' ' ILE . 70.6 p -81.19 129.23 34.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.209 0.528 . . . . 0.0 111.779 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.946 ' HB2' ' HB2' ' B' ' 39' ' ' ALA . 15.7 t80 -137.65 70.65 1.39 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.067 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.96 HG12 HD13 ' B' ' 57' ' ' ILE . 3.4 m -100.56 166.62 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.709 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.709 HG22 ' OG1' ' B' ' 53' ' ' THR . 1.4 m -114.32 68.53 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.57 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.581 ' HE2' ' CG ' ' A' ' 12' ' ' ASP . 37.0 p-80 -62.85 -167.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.571 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.485 ' HB2' ' H ' ' A' ' 70' ' ' THR . 0.7 OUTLIER -176.15 -140.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.786 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.485 ' H ' ' HB2' ' A' ' 69' ' ' GLU . 0.3 OUTLIER 36.76 -99.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.265 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.743 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 175.1 27.04 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.893 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.706 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 98.4 m-70 -119.4 49.14 1.39 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.435 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.714 ' HD2' ' HB3' ' A' ' 86' ' ' PHE . 0.3 OUTLIER -128.15 126.44 41.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 -179.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.894 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.4 tt -134.72 137.48 50.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.997 0.427 . . . . 0.0 111.342 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 10' ' ' ASN . 16.8 t80 -124.06 129.67 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.036 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.865 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.5 OUTLIER -159.1 167.7 28.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.01 0.433 . . . . 0.0 111.358 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.645 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 28.2 t80 -131.21 93.29 3.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.546 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.122 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -48.87 175.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.957 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -29.66 -54.27 0.19 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.665 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.529 ' O ' HG23 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -141.41 32.65 1.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.865 0.364 . . . . 0.0 110.961 179.986 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.86 HG11 ' N ' ' A' ' 82' ' ' ALA . 60.1 t -146.49 170.85 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.056 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.86 ' N ' HG11 ' A' ' 81' ' ' VAL . . . -131.48 153.43 49.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.713 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.76 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -144.27 121.57 5.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.925 0.393 . . . . 0.0 111.42 -179.786 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.895 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 3.2 tp -112.41 90.74 3.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.317 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.906 HD11 ' SG ' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -94.76 146.21 24.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.87 -179.32 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.809 ' CE1' HG12 ' B' ' 66' ' ' VAL . 7.8 p90 177.21 140.56 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.936 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.841 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 6.4 mtpm? -99.18 -179.03 4.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.987 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.881 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -124.59 19.81 8.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.265 0.555 . . . . 0.0 110.723 179.833 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.472 ' O ' ' NZ ' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.379 -1.234 . . . . 0.0 112.538 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.438 ' O ' ' C ' ' B' ' 2' ' ' CYS . 2.5 ttp . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.842 0.353 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.438 ' C ' ' O ' ' B' ' 1' ' ' MET . 0.2 OUTLIER -34.27 -72.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.465 ' HB2' ' H ' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -129.47 -97.96 0.36 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.962 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.465 ' H ' ' HB2' ' B' ' 3' ' ' ASP . 0.2 OUTLIER 67.27 -71.33 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.009 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.476 ' HD2' ' HA ' ' B' ' 5' ' ' LYS . 11.1 mmmt 39.45 28.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.531 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.007 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.44 -167.47 1.77 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.067 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.683 ' O ' ' HE2' ' B' ' 9' ' ' LYS . 75.7 t -152.88 74.33 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.972 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.835 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -42.84 159.78 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.236 0.541 . . . . 0.0 110.861 -179.857 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.683 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 5.7 mmtt -152.15 -14.73 0.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.896 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.579 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.9 OUTLIER -171.4 108.69 0.27 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.778 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.965 ' HB1' HG13 ' B' ' 74' ' ' ILE . . . -141.61 102.77 4.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.876 0.37 . . . . 0.0 111.653 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.785 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 1.7 t70 -85.77 26.28 0.99 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.439 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.875 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 11.0 ttp -114.89 157.53 23.2 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.743 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.749 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -46.24 152.6 0.4 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.619 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.656 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 2.5 mt-10 -56.48 -70.27 0.12 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.127 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.451 ' HA ' ' HG2' ' B' ' 19' ' ' GLN . 0.8 OUTLIER -49.58 -25.67 2.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.989 0.423 . . . . 0.0 110.533 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.751 ' HE1' ' CE2' ' B' ' 50' ' ' TYR . 0.0 OUTLIER -74.3 -41.9 60.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.828 179.796 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.852 ' NE2' ' HB2' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -68.47 -25.37 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.68 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.692 ' HG3' ' N ' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -78.46 -39.98 36.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.016 179.498 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.692 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 0.3 OUTLIER -72.96 -24.4 60.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.053 179.213 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.78 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -74.4 -48.04 30.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.27 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.818 ' HA ' ' CZ ' ' B' ' 76' ' ' PHE . 37.4 t -61.91 -39.76 84.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.463 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 68.7 mt-10 -66.12 -38.81 89.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.067 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.58 ' SG ' ' O ' ' B' ' 20' ' ' ASP . 99.2 m -67.62 -35.25 78.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.712 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.761 ' C ' HD11 ' B' ' 29' ' ' LEU . . . -69.49 -35.8 75.9 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 178.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.743 ' HA ' HD13 ' B' ' 29' ' ' LEU . 88.2 m -65.05 -42.12 94.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.522 178.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.495 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 32.5 mt-30 -54.35 -46.81 73.05 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.585 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.963 ' HB3' HG23 ' B' ' 38' ' ' ILE . . . -74.01 -16.89 61.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.186 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.799 HD12 ' HG ' ' B' ' 78' ' ' LEU . 3.3 mt -80.66 -41.33 23.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.107 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -78.75 -30.22 45.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.799 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.659 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 7.8 mmtp -84.4 -19.46 33.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.623 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.659 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -158.34 149.89 21.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.813 179.679 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.31 27.45 9.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.7 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 1.014 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.3 mm -108.43 106.42 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.928 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.875 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 35.7 mp0 -30.24 -70.71 0.05 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.506 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.33 -60.31 2.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.691 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 1.014 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.1 OUTLIER -44.48 -65.41 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.55 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.963 HG23 ' HB3' ' B' ' 28' ' ' ALA . 10.9 mt -46.64 -45.12 7.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.325 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.946 ' HB2' ' HB2' ' A' ' 65' ' ' TYR . . . -61.99 -43.77 98.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.394 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.738 ' HB3' ' CE1' ' A' ' 65' ' ' TYR . . . -60.82 -64.86 0.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.625 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -42.37 -56.14 3.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.737 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 55.7 mt -46.82 -68.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.647 ' HD3' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -36.45 -57.15 0.77 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.265 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -52.61 -39.74 61.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.462 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.573 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -73.53 -41.88 62.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.196 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.78 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.9 -37.39 87.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.74 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.859 ' HB3' ' HG3' ' B' ' 52' ' ' PRO . 8.0 m-20 -68.32 -46.24 70.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 22.0 mmmt -79.19 -25.11 42.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.573 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.6 tttm -90.16 -12.44 38.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.155 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.751 ' CE2' ' HE1' ' B' ' 17' ' ' MET . 86.0 m-85 -133.39 -71.43 0.51 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.344 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.9 m-20 157.85 107.46 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.069 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.859 ' HG3' ' HB3' ' B' ' 47' ' ' ASP . 72.0 Cg_exo -35.58 156.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.52 2.147 . . . . 0.0 112.691 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.766 HG23 ' CE1' ' B' ' 55' ' ' HIS . 4.7 t -120.94 123.26 42.04 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 123.016 0.527 . . . . 0.0 111.006 -0.02 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.938 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 37.6 m95 -92.79 118.99 31.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.915 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.766 ' CE1' HG23 ' B' ' 53' ' ' THR . 1.9 m-70 -99.54 99.39 10.26 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.739 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 24.4 p -114.96 146.39 41.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.264 0.554 . . . . 0.0 112.471 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.96 HD13 HG12 ' A' ' 66' ' ' VAL . 22.7 mm -128.19 111.51 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.184 178.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.733 HG21 HD12 ' B' ' 83' ' ' ILE . 2.5 p -111.11 135.24 50.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.877 0.37 . . . . 0.0 111.634 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.765 ' O ' HG12 ' B' ' 81' ' ' VAL . . . -165.22 -137.52 2.22 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.967 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.449 ' O ' ' CB ' ' B' ' 61' ' ' ASN . 0.1 OUTLIER -172.33 34.07 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 120.775 0.321 . . . . 0.0 111.269 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.449 ' CB ' ' O ' ' B' ' 60' ' ' ARG . 0.9 OUTLIER 163.81 27.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.776 179.815 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 1.043 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.7 p90 -100.67 165.81 11.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.649 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -121.12 84.29 0.37 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.976 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.727 ' CB ' HD12 ' A' ' 57' ' ' ILE . 3.0 p -79.76 139.27 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.006 0.432 . . . . 0.0 111.444 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.827 ' H ' HD11 ' A' ' 57' ' ' ILE . 4.1 t80 -149.17 64.18 1.03 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.446 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.809 HG12 ' CE1' ' A' ' 86' ' ' PHE . 24.3 m -101.78 140.79 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.487 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 17.4 m -85.33 95.43 9.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.608 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 14.8 p-80 -57.52 -150.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.809 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.608 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER 168.73 116.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.809 HG22 ' HG2' ' B' ' 71' ' ' LYS . 0.5 OUTLIER 81.01 -59.4 0.26 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.476 179.625 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.809 ' HG2' HG22 ' B' ' 70' ' ' THR . 0.0 OUTLIER 174.53 -158.44 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.874 -179.756 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.875 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 29.7 m170 64.1 17.77 10.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.852 ' HA ' ' HA ' ' B' ' 86' ' ' PHE . 4.0 t80 -114.26 77.36 1.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.478 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.965 HG13 ' HB1' ' B' ' 11' ' ' ALA . 1.6 tt -96.0 149.05 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.126 0.489 . . . . 0.0 111.469 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.579 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.3 OUTLIER -140.79 125.5 18.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.619 179.145 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.835 ' HB3' HG13 ' B' ' 8' ' ' ILE . 4.5 p90 -155.3 167.38 30.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.975 0.417 . . . . 0.0 111.24 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.644 ' HH ' ' HA ' ' B' ' 80' ' ' GLN . 10.9 t80 -124.06 111.02 15.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.976 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.007 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -72.65 170.48 14.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.678 179.711 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.498 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.23 -50.0 0.05 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.695 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.703 ' O ' HG22 ' B' ' 81' ' ' VAL . 0.8 OUTLIER -146.05 37.59 1.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.958 0.409 . . . . 0.0 110.692 179.691 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.765 HG12 ' O ' ' B' ' 59' ' ' GLY . 93.3 t -152.08 170.4 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.863 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.647 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -142.66 115.01 8.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 0.0 110.919 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.746 HD11 HG13 ' B' ' 81' ' ' VAL . 0.4 OUTLIER -101.75 129.77 52.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.253 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.819 HD23 ' HB ' ' B' ' 57' ' ' ILE . 0.3 OUTLIER -118.2 87.14 2.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.532 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.714 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -89.46 134.62 34.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.852 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -160.27 126.86 4.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.938 ' HG3' ' HA ' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -110.32 142.95 41.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.024 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.72 ' HB2' ' HE2' ' B' ' 55' ' ' HIS . 0.2 OUTLIER -86.21 19.35 2.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.211 0.529 . . . . 0.0 110.729 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.421 -1.21 . . . . 0.0 112.506 179.901 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.432 ' H2 ' ' HG3' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.776 0.322 . . . . 0.0 111.132 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.3 m -93.07 -61.84 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.816 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 5' ' ' LYS . 40.8 t0 70.1 71.33 0.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.866 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.697 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER 53.27 -87.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.974 -179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.48 ' O ' HD11 ' A' ' 78' ' ' LEU . 0.0 OUTLIER 56.82 97.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.807 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.98 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 160.59 168.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.915 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.669 ' O ' HG11 ' A' ' 7' ' ' VAL . 98.8 t -131.13 60.75 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.929 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.86 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -36.04 132.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.694 -179.897 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -114.33 -16.29 12.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.984 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.622 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 1.7 m-20 -173.99 160.06 3.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.665 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.622 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 171.07 113.86 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.778 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.707 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 41.6 m-20 -98.52 27.62 4.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.024 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.885 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -107.59 168.02 9.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.562 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.885 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -53.69 146.83 12.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.882 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.716 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -56.53 -62.01 2.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.764 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.438 ' H ' ' CD ' ' A' ' 16' ' ' GLU . 2.6 mp0 -53.96 -24.99 18.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.857 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.566 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 60.2 mmm -77.67 -45.86 23.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.99 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.834 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -61.77 -33.16 73.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.72 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.697 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 4.7 mt-30 -75.53 -40.37 57.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.149 0.499 . . . . 0.0 109.7 179.292 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.748 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 1.4 m-20 -69.73 -30.81 68.5 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.548 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.803 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -64.45 -50.31 68.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.824 179.198 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.75 HG13 ' HB2' ' A' ' 6' ' ' ALA . 70.3 t -55.43 -47.4 78.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.009 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -53.73 -39.3 65.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.161 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.496 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -65.43 -41.32 93.64 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.045 179.24 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.769 ' HA ' HD12 ' A' ' 42' ' ' ILE . . . -66.69 -28.94 68.85 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.671 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.6 OUTLIER -72.73 -42.25 64.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.641 178.655 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.518 HE21 ' HB3' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -51.62 -46.06 63.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.528 179.365 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.839 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -81.07 -20.55 41.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.683 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.799 HD11 HD13 ' A' ' 78' ' ' LEU . 6.7 mt -77.46 -29.93 52.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.249 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 -34.77 14.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.204 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.541 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -82.9 -14.14 54.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.449 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.634 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.35 169.7 22.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.761 179.535 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.612 ' C ' HD12 ' A' ' 34' ' ' ILE . 1.3 t30 -137.93 29.18 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.877 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 1.2 mm -116.63 108.22 24.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.065 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.664 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 23.6 mp0 -29.1 -74.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.482 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.4 OUTLIER -42.61 -61.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.753 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.877 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.3 OUTLIER -44.43 -62.85 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.87 ' HB ' HG11 ' A' ' 58' ' ' VAL . 3.3 mt -45.18 -48.46 3.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.899 ' HB1' ' HB2' ' B' ' 65' ' ' TYR . . . -57.94 -43.85 86.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.071 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.788 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -55.94 -64.77 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.067 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.699 ' HD1' ' HB1' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -49.15 -56.8 8.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.931 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.769 HD12 ' HA ' ' A' ' 25' ' ' ALA . 47.3 mt -42.52 -62.52 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.857 ' HE2' ' H ' ' A' ' 54' ' ' TRP . 13.0 tptp -51.49 -60.44 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.01 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -36.93 -56.02 0.89 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.069 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 48' ' ' LYS . 18.3 tt0 -60.97 -69.06 0.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.803 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.3 OUTLIER -37.35 -38.16 0.22 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.315 -179.84 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.726 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.1 OUTLIER -71.58 -38.52 70.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.471 -179.467 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.478 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -101.64 9.96 40.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.723 0.297 . . . . 0.0 111.373 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.468 ' HZ2' ' HB3' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -125.54 -7.48 6.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.323 -179.899 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.748 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 39.8 m-85 -133.04 -63.3 0.77 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.994 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.487 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.1 OUTLIER 161.79 108.86 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.313 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.726 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 73.0 Cg_exo -49.53 153.56 5.11 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.446 2.097 . . . . 0.0 112.434 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.963 HG23 HG22 ' B' ' 67' ' ' THR . 44.5 m -117.06 137.11 52.48 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 122.998 0.519 . . . . 0.0 110.699 0.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.857 ' H ' ' HE2' ' A' ' 43' ' ' LYS . 64.8 m95 -98.76 160.81 14.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.39 0.614 . . . . 0.0 111.748 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.853 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 2.4 m-70 -141.26 100.42 3.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.016 179.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.769 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 0.8 OUTLIER -113.27 144.35 42.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.355 0.597 . . . . 0.0 112.573 -178.051 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.97 HG12 HD22 ' A' ' 84' ' ' LEU . 18.0 mm -132.87 111.82 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.334 179.039 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.87 HG11 ' HB ' ' A' ' 38' ' ' ILE . 2.8 p -111.01 126.83 68.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.933 0.397 . . . . 0.0 111.58 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.585 ' HA3' ' CB ' ' B' ' 62' ' ' PHE . . . -147.48 -151.34 5.4 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.685 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.5 26.02 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.773 0.287 . . . . 0.0 111.586 -179.75 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.685 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 164.5 26.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 0.0 111.143 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.879 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 14.8 p90 -102.67 -179.54 4.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.842 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.775 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -132.6 108.57 0.78 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.785 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.879 ' HB3' ' HE1' ' A' ' 62' ' ' PHE . 7.2 p -93.94 124.75 38.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.982 0.42 . . . . 0.0 111.53 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.809 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 33.1 t80 -135.8 82.14 1.93 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.376 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 1.013 HG11 HD12 ' B' ' 57' ' ' ILE . 14.6 m -125.89 152.27 32.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.4 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.816 HG23 HG21 ' B' ' 53' ' ' THR . 0.6 OUTLIER -79.49 115.71 19.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.617 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.819 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -74.87 148.41 40.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.96 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.733 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 3.5 mm-40 -113.94 -131.52 0.32 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.481 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.59 ' C ' ' H ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -27.57 -99.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.679 -179.56 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.745 ' O ' ' HB2' ' A' ' 13' ' ' MET . 0.1 OUTLIER -70.29 22.49 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.962 0.41 . . . . 0.0 110.697 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.819 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 24.6 m-70 56.97 -85.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.874 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.732 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 164.61 -170.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.895 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.834 HG13 ' HB3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -160.34 110.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.597 179.771 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.594 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 34.6 t80 -103.71 137.26 42.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.605 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.86 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.5 OUTLIER -151.17 169.73 21.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.81 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.774 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 10.2 t80 -126.59 98.11 5.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.002 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.98 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.3 OUTLIER -59.46 177.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.73 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.532 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -56.63 81.4 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.464 179.334 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.774 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.0 OUTLIER 84.1 22.87 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.177 0.513 . . . . 0.0 110.016 -178.9 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.884 ' HB ' ' HB2' ' A' ' 78' ' ' LEU . 72.5 t -142.63 173.02 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.75 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.877 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -146.25 146.26 30.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.695 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.727 HG22 ' HB2' ' A' ' 25' ' ' ALA . 0.7 OUTLIER -135.79 133.1 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.008 0.432 . . . . 0.0 111.531 -179.517 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.97 HD22 HG12 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -118.34 93.96 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.045 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.732 ' O ' ' HB2' ' A' ' 73' ' ' PHE . 0.7 OUTLIER -98.81 124.67 43.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.636 -179.155 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.636 ' HZ ' ' CE2' ' B' ' 86' ' ' PHE . 18.7 p90 -162.72 129.95 3.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.049 179.43 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.852 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 1.0 OUTLIER -104.87 151.17 24.16 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.926 0.393 . . . . 0.0 111.159 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.733 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -109.87 19.02 19.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.329 0.585 . . . . 0.0 110.741 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.415 -1.214 . . . . 0.0 112.593 -179.888 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.482 ' O ' ' C ' ' B' ' 2' ' ' CYS . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.861 0.363 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.482 ' C ' ' O ' ' B' ' 1' ' ' MET . 63.0 m 32.14 91.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.547 ' O ' ' HD3' ' B' ' 4' ' ' ARG . 10.9 m-20 -118.64 61.89 0.78 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.935 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.547 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 27.0 mmt-85 -129.43 -66.01 0.83 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.965 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.547 ' HE2' HG22 ' B' ' 26' ' ' THR . 0.0 OUTLIER 72.51 174.36 0.29 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.828 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.024 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 66.06 164.64 0.18 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.422 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.654 HG12 ' HE3' ' B' ' 9' ' ' LYS . 24.3 t -130.43 71.9 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.739 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.813 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -32.08 152.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.77 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.808 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 1.8 mmpt? -147.16 -6.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.511 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.598 ' HB3' ' HZ ' ' B' ' 73' ' ' PHE . 0.3 OUTLIER -176.65 90.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.516 179.905 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.984 ' HB2' HG13 ' B' ' 74' ' ' ILE . . . -127.98 97.74 4.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.423 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.794 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 1.4 m-20 -95.07 25.96 3.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.067 0.46 . . . . 0.0 110.393 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.716 ' HG3' ' H ' ' B' ' 14' ' ' SER . 12.8 ttp -110.4 168.78 9.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.544 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.716 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.6 OUTLIER -49.24 125.83 11.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.766 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.479 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 45.9 mt-10 -39.29 -56.37 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.785 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -56.41 -30.6 62.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.779 ' HE3' ' CE2' ' B' ' 50' ' ' TYR . 30.8 mmm -72.82 -44.09 61.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.071 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.854 ' HA ' HD13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -62.94 -32.39 73.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -75.03 -42.77 56.56 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.196 0.522 . . . . 0.0 109.682 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.528 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 25.1 m-20 -68.1 -28.87 67.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.511 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.775 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -66.67 -48.62 68.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.956 179.094 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.807 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 90.9 t -55.27 -50.15 66.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.136 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.83 -34.99 68.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.948 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.47 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 3.2 m -69.55 -36.12 76.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.754 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.94 ' HB2' HG23 ' B' ' 83' ' ' ILE . . . -71.36 -28.81 64.32 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.547 HG22 ' HE2' ' B' ' 5' ' ' LYS . 3.7 m -74.31 -40.39 62.27 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.75 178.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.753 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 1.8 mm-40 -56.6 -44.43 81.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.681 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.928 ' HB3' HG22 ' B' ' 38' ' ' ILE . . . -68.21 -36.7 79.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.067 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.79 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.8 mt -65.46 -41.08 93.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -25.88 54.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.736 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.753 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 23.6 mmtm -88.12 -22.65 23.99 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.687 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.529 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -159.66 163.71 34.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.699 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.469 ' OD1' ' N ' ' B' ' 33' ' ' ASN . 0.0 OUTLIER -123.28 29.75 6.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.935 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.709 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.7 mm -113.67 106.41 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.892 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.775 ' HB3' ' HA3' ' A' ' 63' ' ' GLY . 1.2 mp0 -29.89 -70.34 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.898 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.568 ' HG3' HG23 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -43.33 -52.33 5.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.633 179.559 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.709 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 7.0 t0 -55.49 -60.49 3.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.369 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.928 HG22 ' HB3' ' B' ' 28' ' ' ALA . 3.8 mt -42.74 -55.1 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.713 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.963 ' HB3' HG13 ' B' ' 58' ' ' VAL . . . -49.46 -53.73 21.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.809 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -51.37 -69.29 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.263 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.721 ' CD2' ' HB1' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -33.78 -42.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.359 179.134 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 1.03 HG23 HD12 ' B' ' 85' ' ' LEU . 53.6 mt -69.04 -66.35 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.324 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.672 ' HZ2' ' HB ' ' A' ' 67' ' ' THR . 7.3 tttp -40.49 -43.55 1.86 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.075 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -69.02 -49.4 58.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.277 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.54 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 41.6 tt0 -63.22 -25.95 68.57 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.775 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -79.33 -37.81 36.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.874 0.369 . . . . 0.0 110.771 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.945 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.62 -32.82 73.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.609 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.4 mmmt -90.56 -33.78 15.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.221 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.544 ' HD3' ' CE1' ' B' ' 50' ' ' TYR . 7.7 tttp -81.03 -12.66 59.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.387 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.779 ' CE2' ' HE3' ' B' ' 17' ' ' MET . 17.4 m-85 -142.75 -66.59 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.658 0.266 . . . . 0.0 111.596 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.748 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.2 t30 160.74 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.398 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.945 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 21.0 Cg_endo -60.43 169.42 5.29 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.472 2.115 . . . . 0.0 112.377 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.816 HG21 HG23 ' A' ' 67' ' ' THR . 1.8 t -110.89 120.73 43.37 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 122.926 0.49 . . . . 0.0 110.733 0.077 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.83 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 31.2 m95 -90.55 141.23 28.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.46 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.821 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 4.1 m170 -107.1 105.39 15.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.338 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.612 ' HB2' ' CD1' ' B' ' 85' ' ' LEU . 9.8 t -111.74 133.08 54.21 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 1.013 HD12 HG11 ' A' ' 66' ' ' VAL . 23.8 mm -127.08 99.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.56 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.963 HG13 ' HB3' ' B' ' 39' ' ' ALA . 2.6 p -104.98 118.78 52.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.048 0.451 . . . . 0.0 111.847 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.783 ' O ' HG12 ' B' ' 81' ' ' VAL . . . -134.87 -116.03 1.59 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.198 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -174.15 -31.86 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.786 0.327 . . . . 0.0 111.022 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.419 HD21 ' HA ' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -154.67 43.11 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.925 -179.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.923 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 27.9 p90 -99.68 -167.15 1.42 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 0.0 111.07 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.664 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -140.5 98.11 0.23 Allowed Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.709 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.936 ' HA ' HD13 ' A' ' 57' ' ' ILE . 3.8 p -89.22 128.42 35.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.996 0.427 . . . . 0.0 111.668 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.899 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 52.5 t80 -139.48 86.54 2.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.343 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.853 ' HB ' ' HB3' ' A' ' 55' ' ' HIS . 12.2 m -136.92 141.42 40.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.179 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.963 HG22 HG23 ' A' ' 53' ' ' THR . 1.3 t -70.37 139.54 51.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.043 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.759 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -98.76 162.15 13.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.495 ' O ' ' O ' ' B' ' 70' ' ' THR . 0.1 OUTLIER -131.75 -101.26 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.33 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.566 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -46.04 -108.08 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.389 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.687 ' O ' ' HB2' ' B' ' 13' ' ' MET . 2.1 mmtp -70.5 29.3 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.88 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.794 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 37.9 m-70 57.22 -83.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.773 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 163.05 -153.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.73 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.984 HG13 ' HB2' ' B' ' 11' ' ' ALA . 0.6 OUTLIER -172.54 135.6 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.549 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.808 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 5.2 t80 -124.05 139.62 53.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.999 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.813 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.8 OUTLIER -165.73 147.11 7.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.977 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.862 ' HH ' ' HA ' ' B' ' 80' ' ' GLN . 64.5 t80 -112.7 109.5 19.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.024 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.4 mm? -69.1 169.55 11.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.061 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.543 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -19.75 -67.86 0.01 OUTLIER Glycine 0 C--N 1.335 0.479 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.86 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.862 ' HA ' ' HH ' ' B' ' 77' ' ' TYR . 0.0 OUTLIER -130.86 39.0 3.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.049 0.452 . . . . 0.0 110.064 179.223 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.892 HG12 ' H ' ' B' ' 82' ' ' ALA . 93.0 t -152.69 170.18 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.114 -179.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.892 ' H ' HG12 ' B' ' 81' ' ' VAL . . . -131.51 162.15 30.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.367 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.94 HG23 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -145.61 133.98 16.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.977 0.417 . . . . 0.0 111.489 -179.615 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.848 ' HB3' ' HB ' ' B' ' 57' ' ' ILE . 4.9 tp -124.15 88.19 2.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.444 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 1.03 HD12 HG23 ' B' ' 42' ' ' ILE . 0.8 OUTLIER -95.02 122.33 37.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.246 -179.44 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.636 ' CE2' ' HZ ' ' A' ' 86' ' ' PHE . 0.5 OUTLIER -153.52 120.1 5.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.022 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.83 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -86.22 132.06 34.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.893 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.821 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 2.4 m -94.73 19.53 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.228 0.537 . . . . 0.0 110.956 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . 0.471 ' OXT' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.368 -1.24 . . . . 0.0 112.525 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mtt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.759 0.314 . . . . 0.0 111.262 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.61 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -82.5 -134.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.724 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.61 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 1.9 t70 168.85 88.45 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.983 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.961 ' HG3' HG13 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -93.87 -41.14 9.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.654 179.814 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.474 ' C ' ' O ' ' A' ' 4' ' ' ARG . 0.5 OUTLIER 30.67 40.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.295 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.118 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -131.07 -171.05 2.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.128 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 6' ' ' ALA . 25.9 t -145.79 78.69 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.262 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.772 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 1.4 mp -40.03 142.41 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.465 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 3.7 mmpt? -129.83 -12.78 4.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.03 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.483 ' HB3' ' H ' ' A' ' 11' ' ' ALA . 14.4 t30 -154.89 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 1.075 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 76.68 -176.59 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.619 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.769 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 1.0 OUTLIER 162.23 22.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.807 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.909 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 11.0 ttp -114.58 164.59 13.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.687 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 1.048 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 68.5 m -45.3 135.27 6.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.522 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.443 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.2 mm-40 -41.67 -75.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.071 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -44.68 -22.15 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 1.048 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.54 -39.73 31.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.667 ' HG2' ' O ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -67.73 -30.1 69.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.589 179.811 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -45.77 19.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -68.18 -29.49 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.484 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.804 ' OG ' HG22 ' A' ' 74' ' ' ILE . 0.2 OUTLIER -66.66 -50.83 61.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.086 179.182 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.961 HG13 ' HG3' ' A' ' 4' ' ' ARG . 58.0 t -57.13 -40.36 72.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.343 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 4.2 mt-10 -63.85 -34.66 78.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.203 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.46 ' O ' ' CG ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -71.78 -34.06 69.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.764 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.669 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -73.42 -34.15 65.33 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 1.038 ' HA ' HD12 ' A' ' 29' ' ' LEU . 42.0 m -71.71 -40.19 69.64 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.619 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.828 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -56.17 -43.33 78.28 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.249 178.94 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.877 ' HB2' HG23 ' A' ' 38' ' ' ILE . . . -74.93 -22.92 58.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.807 178.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 1.038 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.9 mt -73.46 -38.38 65.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.945 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.01 -25.21 26.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.746 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -83.92 -35.27 24.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.725 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.651 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -149.92 150.58 32.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.627 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -127.51 48.57 2.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.772 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.85 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 40.4 mm -115.45 43.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.672 ' HG2' ' HA ' ' B' ' 62' ' ' PHE . 3.1 mp0 34.56 -87.56 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.596 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.613 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -43.19 -53.75 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.865 0.364 . . . . 0.0 110.456 179.53 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.85 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.4 t70 -45.86 -61.94 1.52 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.588 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.877 HG23 ' HB2' ' A' ' 28' ' ' ALA . 3.7 mt -45.5 -58.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.814 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -49.29 -54.61 16.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.722 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -42.53 -55.24 3.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.111 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.552 ' HD1' ' HB1' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.817 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.7 HG22 HD13 ' A' ' 85' ' ' LEU . 64.2 mt -47.68 -69.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.218 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.855 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -49.97 -67.08 0.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.987 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.768 ' HD2' ' N ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -33.0 -59.69 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.911 -179.974 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.768 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 5.2 tp10 -54.66 -54.84 36.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.695 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -52.66 -31.65 38.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.942 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.741 ' OD1' ' HB2' ' A' ' 54' ' ' TRP . 0.9 OUTLIER -72.94 -32.15 65.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.872 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mmmm -106.27 4.61 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.372 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.484 ' O ' ' CG ' ' A' ' 50' ' ' TYR . 6.2 tttp -123.98 13.75 9.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.789 0.328 . . . . 0.0 111.101 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.664 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 57.2 m-85 -159.94 -66.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.12 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.488 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 0.6 OUTLIER 162.09 115.57 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.726 -179.773 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.726 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 36.4 Cg_endo -64.98 170.49 10.25 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.433 2.089 . . . . 0.0 112.398 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.723 ' HG1' HG21 ' B' ' 67' ' ' THR . 1.5 t -102.65 128.12 49.47 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 122.86 0.464 . . . . 0.0 110.358 -0.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.81 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 63.6 m95 -94.27 151.44 19.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.407 0.622 . . . . 0.0 111.929 -179.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.808 ' HB2' ' CE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -136.67 94.19 2.96 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.954 179.257 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.748 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 8.8 p -115.97 154.9 29.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.349 0.595 . . . . 0.0 112.422 -178.122 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.956 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 16.3 mm -126.96 174.71 10.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.001 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.71 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 8.1 p -170.88 110.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.961 0.41 . . . . 0.0 111.76 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.737 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -154.39 -135.83 2.15 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.765 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.5 ptt180 -173.69 -9.85 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.533 HD21 ' N ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -148.72 44.83 1.02 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.087 -179.896 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.875 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -120.19 165.73 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.93 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.853 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -112.77 86.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.792 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.98 ' HA ' HD12 ' B' ' 57' ' ' ILE . 2.9 p -81.91 118.56 23.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.045 0.45 . . . . 0.0 111.58 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.871 ' HB2' ' HB2' ' B' ' 39' ' ' ALA . 7.4 t80 -132.37 76.68 1.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.945 HG11 HD11 ' B' ' 57' ' ' ILE . 5.5 m -127.55 140.44 49.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.719 HG22 ' NE2' ' B' ' 55' ' ' HIS . 3.3 t -95.69 120.52 36.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.43 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -60.95 -164.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.876 -179.89 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.508 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 1.0 OUTLIER -127.11 -46.84 1.5 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.346 -179.752 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.5 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 28.3 m -157.92 -42.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.481 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.769 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 7.7 mtpt -164.7 -159.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.758 0.313 . . . . 0.0 110.882 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 1.05 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 0.0 OUTLIER 56.17 18.82 3.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.011 0.434 . . . . 0.0 110.436 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.836 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 7.0 t80 -116.15 101.61 8.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.498 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 1.075 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -121.4 118.25 55.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.316 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -115.21 94.6 4.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.763 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.802 ' CZ ' ' HA ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -114.7 -178.88 3.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.164 -179.778 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.68 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 16.1 t80 -140.31 102.69 4.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.118 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -59.64 173.05 0.6 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.273 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.96 -44.86 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.936 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.418 ' N ' ' O ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -148.21 26.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.22 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.737 HG12 ' O ' ' A' ' 59' ' ' GLY . 72.2 t -139.65 168.3 18.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.989 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.736 ' H ' HG12 ' A' ' 81' ' ' VAL . . . -136.63 125.88 24.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.744 HG22 ' O ' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -113.23 119.99 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.993 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.956 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 21.4 tp -100.78 80.45 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.18 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.714 ' CB ' HG21 ' A' ' 74' ' ' ILE . 0.2 OUTLIER -86.32 137.78 32.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.072 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.836 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -174.23 127.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.563 179.635 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 1.05 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -90.14 -169.75 2.53 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.925 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.654 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -122.78 19.73 10.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.308 0.575 . . . . 0.0 110.81 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.086 0 CA-C-O 118.413 -1.215 . . . . 0.0 112.499 -179.99 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.596 ' H3 ' ' HB2' ' B' ' 4' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.77 0.319 . . . . 0.0 111.129 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.612 ' SG ' ' N ' ' B' ' 3' ' ' ASP . 0.0 OUTLIER 70.09 -77.92 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.781 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.612 ' N ' ' SG ' ' B' ' 2' ' ' CYS . 0.4 OUTLIER -139.65 36.45 2.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.88 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.596 ' HB2' ' H3 ' ' B' ' 1' ' ' MET . 0.1 OUTLIER -104.81 -89.34 0.42 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.684 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.622 ' HG2' ' H ' ' B' ' 6' ' ' ALA . 22.8 tttt 76.62 -152.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.724 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.073 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 52.74 175.85 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.183 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.741 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 59.0 t -147.83 71.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.727 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.802 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -34.8 140.32 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.521 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.741 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 3.2 mmtp -115.27 -25.58 7.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.213 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.406 ' HB2' ' H ' ' B' ' 11' ' ' ALA . 31.2 m-20 -140.83 -87.97 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.165 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 1.068 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 62.64 106.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.095 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -109.28 24.32 13.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.648 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.763 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -107.82 173.31 6.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.763 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.2 OUTLIER -54.61 128.0 30.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.856 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.58 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 1.7 mm-40 -39.85 -64.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -50.36 -27.45 6.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.548 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.645 ' HB2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -75.55 -31.61 60.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.701 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.745 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -71.29 -36.2 71.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.395 179.65 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.542 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 20.1 mt-30 -74.82 -35.57 62.44 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.88 -34.91 62.29 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.841 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 1.4 t -65.19 -42.49 93.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.756 179.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.916 HG12 ' HB2' ' B' ' 6' ' ' ALA . 91.2 t -60.94 -50.0 82.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.332 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.542 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 20.7 mt-10 -53.75 -38.61 64.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.297 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.607 ' SG ' ' CE1' ' B' ' 46' ' ' PHE . 71.9 m -65.71 -38.46 89.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.011 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.898 ' HA ' HD12 ' B' ' 42' ' ' ILE . . . -68.77 -30.2 68.75 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.603 ' HA ' HD12 ' B' ' 29' ' ' LEU . 0.7 OUTLIER -72.43 -40.2 67.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.361 -1.291 . . . . 0.0 109.926 178.787 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.838 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -56.86 -43.77 81.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.892 179.354 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.933 ' HB1' ' HB3' ' B' ' 41' ' ' HIS . . . -73.51 -34.29 65.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.423 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.645 HD11 ' HG ' ' B' ' 78' ' ' LEU . 2.3 mt -65.53 -40.82 93.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.876 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.96 -18.52 34.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 1.1 mmmm -83.38 -21.14 33.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.568 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.1 OUTLIER -153.01 -49.0 0.1 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.792 -179.921 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.471 ' CB ' ' O ' ' B' ' 32' ' ' TYR . 3.4 t-20 83.37 28.42 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.777 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.875 HD12 ' N ' ' B' ' 34' ' ' ILE . 1.1 mp -111.2 140.76 29.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.736 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.853 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -53.91 -70.91 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.897 0.379 . . . . 0.0 110.62 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.425 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -54.18 -55.86 23.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.599 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 12.3 t0 -47.4 -60.74 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.723 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.734 ' CG2' ' HB2' ' B' ' 28' ' ' ALA . 26.6 mt -46.88 -60.66 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.982 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.871 ' HB2' ' HB2' ' A' ' 65' ' ' TYR . . . -40.94 -46.1 2.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 0.0 110.562 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.807 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -63.08 -62.93 1.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.406 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.933 ' HB3' ' HB1' ' B' ' 28' ' ' ALA . 0.8 OUTLIER -39.23 -42.3 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.59 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.898 HD12 ' HA ' ' B' ' 25' ' ' ALA . 7.9 mt -72.47 -70.14 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.256 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.78 ' HD3' ' HD2' ' A' ' 65' ' ' TYR . 27.9 tttp -36.97 -48.02 0.74 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.627 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 6.5 mttt -62.39 -56.03 22.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.261 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.761 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -57.01 -58.32 8.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.831 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.841 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -40.57 -64.24 0.55 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.958 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.784 ' HB2' ' HG3' ' B' ' 52' ' ' PRO . 2.8 p30 -46.4 -42.41 15.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.844 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.761 ' HG3' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -69.93 -36.87 75.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.865 -179.379 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.484 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.35 -9.66 46.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.693 -179.212 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.753 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 92.8 m-85 -127.5 -70.05 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.454 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.753 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 5.7 t-20 161.06 109.45 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.035 -179.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.784 ' HG3' ' HB2' ' B' ' 47' ' ' ASP . 96.8 Cg_exo -43.53 154.65 0.2 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 122.344 2.029 . . . . 0.0 112.479 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.632 HG21 ' HZ3' ' B' ' 43' ' ' LYS . 6.1 m -119.2 134.62 55.11 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 122.927 0.491 . . . . 0.0 110.652 0.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.763 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 45.0 m95 -100.12 125.71 46.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.055 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.909 ' HB3' HG12 ' A' ' 66' ' ' VAL . 62.8 m170 -93.77 94.76 8.72 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.814 ' HB2' HD13 ' B' ' 85' ' ' LEU . 0.7 OUTLIER -102.52 151.39 22.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -177.37 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.98 HD12 ' HA ' ' A' ' 64' ' ' SER . 13.7 mm -139.83 155.82 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.386 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.757 HG21 ' CD1' ' B' ' 83' ' ' ILE . 1.5 p -162.11 109.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 111.59 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.77 ' HA3' ' HA ' ' A' ' 62' ' ' PHE . . . -136.23 -123.28 2.26 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.832 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' B' ' 60' ' ' ARG . 0.8 OUTLIER -166.09 -23.88 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.57 0.224 . . . . 0.0 111.523 179.907 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.612 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 1.5 m-20 -157.61 46.25 0.37 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.824 0.345 . . . . 0.0 111.282 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.875 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.2 p90 -102.88 175.08 5.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.938 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.79 87.43 0.41 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.375 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.79 ' HB2' HD21 ' B' ' 84' ' ' LEU . 10.9 p -85.21 121.64 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.958 0.409 . . . . 0.0 111.105 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.882 ' H ' HD13 ' A' ' 57' ' ' ILE . 11.6 t80 -134.18 61.33 1.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.629 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.799 HG12 ' HE2' ' A' ' 86' ' ' PHE . 17.5 m -96.7 164.65 2.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.16 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.723 HG21 ' HG1' ' A' ' 53' ' ' THR . 93.5 m -101.7 98.93 9.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.841 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -43.36 169.85 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.714 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.8 OUTLIER -142.13 -119.78 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.99 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.577 ' C ' ' H ' ' B' ' 72' ' ' HIS . 41.5 p -39.4 -98.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.014 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.514 ' O ' ' HB2' ' B' ' 13' ' ' MET . 3.4 mmmm -68.74 18.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.77 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.841 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 20.1 m170 65.78 -88.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.757 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 2.4 p90 165.74 -176.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.0 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 1.068 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -156.67 114.63 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.545 179.305 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.801 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 1.3 t80 -100.4 137.71 38.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.918 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.802 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 1.0 OUTLIER -162.62 156.83 21.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.824 0.345 . . . . 0.0 111.376 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.598 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 2.1 t80 -116.89 112.61 21.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.292 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.073 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.1 mm? -69.92 170.31 11.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.639 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.5 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -28.5 -36.29 0.01 OUTLIER Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.497 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.577 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.4 OUTLIER -158.62 44.35 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.921 0.391 . . . . 0.0 110.694 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.902 HG13 ' H ' ' B' ' 82' ' ' ALA . 37.7 t -160.02 169.36 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.036 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.902 ' H ' HG13 ' B' ' 81' ' ' VAL . . . -135.88 111.13 9.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.344 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.761 ' HB ' ' CZ ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -98.64 133.61 40.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.157 0.503 . . . . 0.0 112.012 -179.191 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.801 ' HB2' ' CE1' ' B' ' 75' ' ' TYR . 0.4 OUTLIER -118.85 94.39 4.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.768 179.423 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.814 HD13 ' HB2' ' B' ' 56' ' ' CYS . 0.5 OUTLIER -98.24 135.7 39.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -179.031 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.729 ' O ' ' HB2' ' B' ' 55' ' ' HIS . 9.3 p90 -174.43 121.03 0.26 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.84 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.763 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -90.49 161.51 15.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 110.923 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.714 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -117.76 21.23 13.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.338 0.59 . . . . 0.0 110.486 179.774 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.151 0 CA-C-O 118.325 -1.264 . . . . 0.0 112.504 -179.806 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.451 ' HA ' ' HZ2' ' A' ' 5' ' ' LYS . 1.6 ptt? . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.872 0.368 . . . . 0.0 111.111 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.4 t 75.61 -56.92 0.59 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.896 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.47 -174.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.87 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.43 ' CD ' ' N ' ' A' ' 4' ' ' ARG . 1.0 OUTLIER -67.85 -73.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.087 -179.828 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.451 ' HZ2' ' HA ' ' A' ' 1' ' ' MET . 1.3 mtmt 68.76 -163.27 0.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.965 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.959 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.41 153.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.521 ' O ' ' HG2' ' A' ' 9' ' ' LYS . 92.4 t -118.66 71.12 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.834 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.873 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -35.63 137.02 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.521 ' HG2' ' O ' ' A' ' 7' ' ' VAL . 12.0 mmtt -125.82 -11.26 6.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.647 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.559 ' O ' ' HE1' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -168.52 87.12 0.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.799 -179.833 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.749 ' HB3' HG12 ' A' ' 74' ' ' ILE . . . -121.91 109.42 14.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.911 0.386 . . . . 0.0 111.685 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.618 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 2.7 m-20 -112.23 30.66 6.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.123 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.691 ' HG3' ' H ' ' A' ' 14' ' ' SER . 11.3 ttp -117.89 171.05 8.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.761 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.714 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 m -53.55 134.62 40.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.028 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.627 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 tm-20 -45.99 -68.27 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.93 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.708 ' HA ' ' NE2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -44.49 -27.33 0.44 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.831 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.693 ' HE2' ' CE2' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -75.79 -50.03 16.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.541 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.983 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -58.72 -26.83 64.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.481 179.738 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.708 ' NE2' ' HA ' ' A' ' 16' ' ' GLU . 4.2 pt20 -77.85 -45.29 24.74 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.423 ' OD2' ' O ' ' A' ' 16' ' ' GLU . 36.5 m-20 -67.4 -26.53 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.563 178.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.777 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 28.8 t -68.0 -52.57 34.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.612 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.816 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 47.5 t -54.5 -47.7 70.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.48 -35.81 72.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.95 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.729 ' SG ' HG23 ' A' ' 42' ' ' ILE . 10.2 t -67.29 -35.4 79.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.986 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.802 ' HB2' HG23 ' A' ' 83' ' ' ILE . . . -72.86 -33.99 66.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.612 ' HA ' HD12 ' A' ' 29' ' ' LEU . 2.4 m -69.62 -37.32 76.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.498 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 2.7 mt-30 -61.78 -41.73 98.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.855 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.735 ' HB3' ' CG2' ' A' ' 38' ' ' ILE . . . -79.5 -17.4 54.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.138 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.651 HD12 ' C ' ' A' ' 25' ' ' ALA . 5.5 mt -80.97 -37.01 30.05 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.971 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.21 -26.96 23.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.249 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.498 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -85.07 -23.6 28.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.951 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.602 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -144.29 -161.2 1.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 5.5 t-20 -166.32 28.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.613 179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 1.034 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.4 mm -118.39 103.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.665 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.652 ' HA ' HD11 ' A' ' 38' ' ' ILE . 1.0 OUTLIER -26.33 -77.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.012 0.434 . . . . 0.0 110.821 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.509 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -40.36 -42.15 1.51 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.905 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 1.034 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -64.89 -58.75 5.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.735 ' CG2' ' HB3' ' A' ' 28' ' ' ALA . 3.8 mt -46.82 -48.42 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.765 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.56 -38.86 82.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.867 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.791 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -59.85 -67.71 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.015 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.643 ' HD1' ' HB2' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -50.39 -49.96 52.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.824 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.731 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 98.2 mt -49.99 -67.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.167 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.791 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 4.5 tmtt? -51.25 -40.75 59.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.58 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 1.1 tppt? -54.39 -57.37 11.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.015 0.436 . . . . 0.0 110.736 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 49' ' ' LYS . 5.3 mt-10 -54.0 -54.57 37.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.644 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.777 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.7 m-85 -52.23 -46.75 65.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.867 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.791 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.81 -12.54 61.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.292 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -123.66 13.21 9.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.739 0.304 . . . . 0.0 111.259 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' A' ' 45' ' ' GLU . 6.0 ttmm -129.96 -31.61 1.92 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.189 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.672 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 60.0 m-85 -109.82 -57.23 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.074 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.763 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 0.0 OUTLIER 160.83 114.22 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.433 -179.789 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.728 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 16.5 Cg_endo -57.16 165.92 4.82 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.355 2.037 . . . . 0.0 112.455 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.492 HG22 ' CE1' ' A' ' 55' ' ' HIS . 1.2 m -108.66 124.89 51.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 122.974 0.509 . . . . 0.0 110.361 -0.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.765 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.5 m95 -96.89 160.84 14.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.607 . . . . 0.0 111.996 -179.329 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.817 ' HD2' ' HA ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -152.43 111.98 3.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.079 179.352 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.812 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 13.7 p -120.3 151.61 38.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.91 HD12 ' HA ' ' B' ' 64' ' ' SER . 20.8 mm -126.03 118.36 51.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.444 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.765 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.4 p -113.04 124.03 69.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.511 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -157.9 173.84 35.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.275 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.485 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.5 OUTLIER -137.7 40.05 2.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.678 0.275 . . . . 0.0 111.295 -179.632 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.485 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER 167.89 28.8 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.919 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.882 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 15.7 p90 -117.0 -172.32 2.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.163 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.794 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.63 102.49 0.27 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.737 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.954 ' HA ' HD13 ' B' ' 57' ' ' ILE . 63.6 p -84.87 138.22 32.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.063 0.459 . . . . 0.0 111.731 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.925 ' HB3' ' HB3' ' B' ' 39' ' ' ALA . 54.8 t80 -153.32 89.63 1.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.034 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.9 HG12 HD12 ' B' ' 57' ' ' ILE . 6.2 m -135.18 -161.44 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.203 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.739 HG22 ' N ' ' A' ' 68' ' ' HIS . 0.7 OUTLIER -99.88 -161.16 0.85 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.794 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.739 ' N ' HG22 ' A' ' 67' ' ' THR . 38.4 p-80 -168.42 122.53 0.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.804 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.515 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -130.83 157.89 41.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.403 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 74.94 -85.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.047 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.532 ' O ' ' HB2' ' A' ' 13' ' ' MET . 28.7 mttt -109.96 14.44 23.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.696 ' O ' ' HB2' ' A' ' 68' ' ' HIS . 6.7 m170 71.64 -86.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.752 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.665 ' HB3' ' CB ' ' A' ' 86' ' ' PHE . 1.8 p90 162.3 -167.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.436 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.983 HG13 ' HB3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -165.39 110.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.994 0.426 . . . . 0.0 111.673 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.737 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -100.39 138.06 37.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.079 179.198 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.884 ' HE1' HG22 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -159.22 132.97 7.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.979 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.599 ' HA ' ' O ' ' A' ' 81' ' ' VAL . 18.7 t80 -98.95 102.37 14.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.798 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.959 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.2 mm? -55.82 170.02 0.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.763 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.89 -33.25 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.661 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.699 ' O ' HG21 ' A' ' 81' ' ' VAL . 0.4 OUTLIER -160.08 39.84 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 111.094 -179.812 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.873 HG12 ' N ' ' A' ' 82' ' ' ALA . 81.3 t -156.95 165.31 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.746 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.873 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -125.82 140.97 52.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.553 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.802 HG23 ' HB2' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -134.18 130.73 54.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.979 0.418 . . . . 0.0 111.446 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.812 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -120.35 97.7 5.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.851 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.741 HD23 ' OG ' ' A' ' 21' ' ' SER . 1.4 mp -99.65 124.34 44.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.61 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.665 ' CB ' ' HB3' ' A' ' 73' ' ' PHE . 3.0 p90 -166.04 140.79 4.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.29 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.817 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 15.8 mtpt -90.24 -147.18 0.19 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.593 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.673 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -166.21 18.96 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.386 0.612 . . . . 0.0 110.473 179.681 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.414 -1.214 . . . . 0.0 112.552 179.954 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.724 ' O ' ' HG2' ' B' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.872 0.368 . . . . 0.0 111.184 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' B' ' 3' ' ' ASP . 0.0 OUTLIER -164.17 150.3 11.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.86 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' B' ' 3' ' ' ASP . 0.4 OUTLIER 164.64 -161.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.908 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.576 ' O ' ' HB3' ' B' ' 5' ' ' LYS . 1.9 tpp85 30.94 -104.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.056 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.58 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.7 OUTLIER 79.32 31.04 0.29 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.667 -179.757 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.066 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.46 -165.94 1.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.454 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.75 HG22 ' O ' ' B' ' 6' ' ' ALA . 87.7 t -154.08 75.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.195 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.744 ' HA ' ' CB ' ' B' ' 76' ' ' PHE . 1.3 mp -34.69 140.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.266 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.441 ' HE3' ' HB3' ' B' ' 77' ' ' TYR . 7.0 mmtp -119.55 -11.32 9.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.769 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.603 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 1.2 t-20 -168.7 -94.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.392 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.892 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 80.41 -179.67 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.598 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.4 m-20 177.15 35.26 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.694 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.743 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 19.6 ttp -130.87 167.66 18.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.838 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.587 ' O ' ' HB2' ' B' ' 17' ' ' MET . 0.0 OUTLIER -48.63 131.3 17.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.91 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.457 ' O ' ' N ' ' B' ' 18' ' ' GLN . 1.7 mp0 -40.99 -64.92 0.48 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.671 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.64 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 1.1 mm-40 -46.32 -35.96 5.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.305 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.743 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 43.9 mmm -68.34 -33.72 74.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.049 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.884 ' HB3' HD11 ' B' ' 74' ' ' ILE . 0.7 OUTLIER -73.54 -33.74 64.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.137 179.232 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.718 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 13.1 pt20 -78.0 -36.36 48.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.582 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.662 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER -76.53 -31.64 57.76 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.323 178.623 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.801 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -67.88 -49.13 63.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.861 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.795 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 48.6 t -59.47 -42.94 89.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.228 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.718 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 2.2 mt-10 -60.71 -34.33 74.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.079 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 47.1 m -68.85 -38.5 79.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.118 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.677 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -68.98 -28.23 66.43 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.856 ' HA ' HD12 ' B' ' 29' ' ' LEU . 4.2 m -72.05 -37.74 69.63 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.64 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.726 ' O ' ' HD3' ' B' ' 31' ' ' LYS . 44.2 mt-30 -59.14 -45.71 90.24 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.454 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.924 ' HB3' ' HA ' ' B' ' 38' ' ' ILE . . . -75.81 -20.37 58.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.486 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.856 HD12 ' HA ' ' B' ' 26' ' ' THR . 4.8 mt -76.42 -45.1 33.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.054 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.29 -23.74 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.992 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.726 ' HD3' ' O ' ' B' ' 27' ' ' GLN . 1.3 mttp -84.93 -33.52 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.731 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.631 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -141.03 -175.94 4.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.63 179.857 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -145.97 34.82 1.01 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.892 0.377 . . . . 0.0 110.842 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.996 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.5 mm -120.23 103.82 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.084 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.794 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -29.57 -64.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 110.698 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.48 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 11.9 mmmt -50.86 -54.75 21.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.076 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.996 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.4 m-20 -54.69 -61.62 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.567 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.924 ' HA ' ' HB3' ' B' ' 28' ' ' ALA . 9.9 mt -41.15 -45.64 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.757 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.925 ' HB3' ' HB3' ' A' ' 65' ' ' TYR . . . -64.83 -45.59 85.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.721 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.812 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -54.35 -57.09 12.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.949 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.764 ' CE1' ' HB3' ' B' ' 37' ' ' ASP . 0.1 OUTLIER -54.55 -40.47 68.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.97 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.741 HG13 ' O ' ' B' ' 38' ' ' ILE . 49.1 mt -64.5 -68.89 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.645 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -40.56 -43.04 1.8 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.79 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.6 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 3.9 mtpp -62.56 -54.31 41.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.5 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 10.4 mt-10 -64.69 -25.1 67.8 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.075 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.801 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -76.96 -46.41 24.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.921 0.391 . . . . 0.0 110.882 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.763 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.3 p30 -66.76 -24.68 66.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.477 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.464 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -89.94 -42.34 11.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.057 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.5 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -80.27 -14.56 58.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.36 -179.584 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.662 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 43.5 m-85 -131.11 -71.16 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.645 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 0.5 OUTLIER 157.39 118.9 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.763 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 26.6 Cg_endo -61.52 170.14 5.87 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.512 2.141 . . . . 0.0 112.347 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.672 ' CG2' ' HB ' ' A' ' 67' ' ' THR . 1.9 m -101.91 136.83 41.07 Favored 'General case' 0 C--N 1.343 0.287 0 C-N-CA 123.044 0.538 . . . . 0.0 110.612 0.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.79 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 56.4 m95 -107.92 105.45 15.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.505 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.786 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 5.9 m170 -78.25 93.83 4.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.767 ' HB3' HD13 ' B' ' 85' ' ' LEU . 0.3 OUTLIER -108.5 140.62 41.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.357 0.599 . . . . 0.0 112.589 -178.017 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.954 HD13 ' HA ' ' A' ' 64' ' ' SER . 19.1 mm -135.56 103.45 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.913 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.674 HG21 ' O ' ' B' ' 82' ' ' ALA . 2.5 p -103.52 125.41 58.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.678 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.743 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.2 -110.62 0.73 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.959 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.694 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 6.9 ptt180 168.74 3.57 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 178.8 29.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.683 0.277 . . . . 0.0 111.461 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.876 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 2.9 p90 -92.96 -167.34 1.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.055 0.455 . . . . 0.0 110.832 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -139.94 86.11 0.21 Allowed Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.833 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.91 ' HA ' HD12 ' A' ' 57' ' ' ILE . 5.8 p -82.33 122.51 28.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.065 0.46 . . . . 0.0 111.32 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.791 ' CD1' ' HA ' ' A' ' 40' ' ' ALA . 46.6 t80 -133.44 83.53 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.426 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.787 ' HB ' ' HB3' ' A' ' 55' ' ' HIS . 7.5 m -118.85 150.34 21.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.632 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 18.4 m -73.18 77.87 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.603 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.45 ' HB2' ' CB ' ' B' ' 73' ' ' PHE . 29.4 p-80 -59.59 169.01 1.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.821 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 178.11 173.54 0.61 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.43 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 1.6 m 75.81 -89.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.775 ' HE2' ' CE1' ' B' ' 72' ' ' HIS . 0.5 OUTLIER 166.53 43.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.775 ' CE1' ' HE2' ' B' ' 71' ' ' LYS . 84.9 m-70 -138.85 31.25 2.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.786 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 7.6 t80 -111.8 79.36 1.21 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.566 179.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.892 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -102.87 123.88 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.173 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.711 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -111.91 137.02 50.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.344 179.645 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.795 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 8.0 p90 -161.18 168.33 24.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.982 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.607 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 47.1 t80 -133.92 115.49 14.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.066 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.96 170.1 11.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.619 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.502 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.09 -48.07 0.05 OUTLIER Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.733 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.439 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -146.45 38.78 1.05 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.877 0.37 . . . . 0.0 110.747 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.751 HG23 ' CD2' ' B' ' 29' ' ' LEU . 76.5 t -152.25 167.67 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.961 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.723 ' N ' HG11 ' B' ' 81' ' ' VAL . . . -134.32 143.18 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.701 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.615 ' HB ' ' CZ ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -135.5 128.9 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.996 0.427 . . . . 0.0 111.212 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.939 HD21 HG12 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -121.15 96.83 5.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.521 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.786 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 1.8 mp -100.09 117.86 35.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.716 ' HA ' ' O ' ' B' ' 72' ' ' HIS . 1.0 OUTLIER -150.99 126.59 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.923 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.79 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.6 OUTLIER -103.7 152.76 21.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.82 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.786 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -111.16 17.64 20.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.255 0.55 . . . . 0.0 110.628 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . 0.471 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.093 0 CA-C-O 118.419 -1.212 . . . . 0.0 112.622 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.575 ' SD ' ' N ' ' A' ' 2' ' ' CYS . 5.4 tpp . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.836 0.35 . . . . 0.0 111.151 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.575 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.5 OUTLIER 43.09 -171.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.863 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -112.48 -136.63 0.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.004 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.65 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.4 OUTLIER 74.49 -66.82 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.98 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.04 -168.31 0.2 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.817 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.084 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.62 166.6 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.646 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.476 ' O ' ' O ' ' A' ' 8' ' ' ILE . 65.2 t -134.52 71.51 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.767 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.851 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -31.86 152.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.947 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.587 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -142.81 -11.63 0.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.501 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.47 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER 179.63 103.88 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.53 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.867 ' HB3' HG13 ' A' ' 74' ' ' ILE . . . -140.02 130.03 24.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.561 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.58 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 27.4 m-20 -121.17 24.15 10.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.304 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.671 ' HG3' ' H ' ' A' ' 14' ' ' SER . 17.0 ttp -104.01 170.47 7.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.794 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.683 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 0.3 OUTLIER -46.82 138.86 5.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.9 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.594 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 24.9 mp0 -50.26 -64.78 0.7 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 6.4 tt0 -58.21 -16.72 14.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.974 0.416 . . . . 0.0 110.097 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.683 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -81.75 -39.15 24.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.669 179.61 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.669 ' CB ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.16 -37.94 84.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.521 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.65 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 4.4 mt-30 -75.21 -36.29 61.41 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.526 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 2.1 m-20 -69.5 -35.11 75.23 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.549 178.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.788 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 1.2 t -64.22 -45.37 88.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.728 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.793 HG13 ' HB3' ' A' ' 6' ' ' ALA . 69.5 t -55.97 -51.13 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.327 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -56.93 -34.18 67.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.544 ' HB3' HG21 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -68.88 -34.35 75.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.694 179.131 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.739 ' CB ' HG13 ' A' ' 83' ' ' ILE . . . -72.33 -38.39 68.65 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.806 ' HA ' HD12 ' A' ' 29' ' ' LEU . 34.2 m -67.3 -38.06 84.4 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.711 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.771 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -58.65 -44.31 90.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.512 178.916 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.929 ' HB2' ' HB3' ' A' ' 41' ' ' HIS . . . -72.57 -26.69 61.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.698 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 1.041 HD11 ' HG ' ' A' ' 78' ' ' LEU . 1.6 mt -74.19 -35.82 63.99 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.851 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.94 -28.82 49.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.399 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.771 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 25.5 mmtt -85.2 -33.71 22.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.209 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.666 ' HH ' ' HD1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.4 140.8 16.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.503 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -104.75 29.95 5.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.73 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 39.7 mm -104.92 110.22 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.063 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.502 ' HB3' ' HA3' ' B' ' 63' ' ' GLY . 7.3 mp0 -27.5 -85.83 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.025 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.0 pttt -39.13 -34.45 0.17 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.904 179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.73 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 49.2 t0 -66.37 -50.88 62.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.069 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.92 HG23 HD11 ' A' ' 42' ' ' ILE . 5.7 mt -58.84 -43.68 88.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.765 ' HB1' ' CB ' ' B' ' 65' ' ' TYR . . . -60.23 -39.58 87.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.705 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.79 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -65.55 -63.29 1.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.929 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -42.77 -62.54 0.98 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.478 179.531 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.92 HD11 HG23 ' A' ' 38' ' ' ILE . 16.4 mt -45.42 -66.15 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.356 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.649 ' HB3' ' CE2' ' B' ' 65' ' ' TYR . 0.6 OUTLIER -42.25 -66.23 0.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.938 -179.813 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.529 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 5.0 tptp -36.61 -54.09 0.88 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.667 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -57.88 -68.82 0.21 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.728 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.788 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.3 m-85 -37.63 -53.31 1.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.94 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.684 ' OD1' ' HG3' ' A' ' 52' ' ' PRO . 4.5 t70 -54.97 -37.32 66.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.868 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -104.88 11.96 33.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 179.85 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 2.8 mmmt -131.12 11.58 5.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.279 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.621 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 77.8 m-85 -157.58 -63.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.63 0.253 . . . . 0.0 111.487 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.621 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER 164.17 107.87 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.58 -179.644 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.684 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 82.5 Cg_exo -47.27 152.23 2.32 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.37 2.046 . . . . 0.0 112.43 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.693 ' O ' ' HB2' ' A' ' 87' ' ' LYS . 91.0 m -117.88 133.31 56.05 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 123.08 0.552 . . . . 0.0 110.557 -0.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.809 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.5 m95 -97.44 143.93 27.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.173 0.511 . . . . 0.0 111.784 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.742 ' HB3' ' CB ' ' B' ' 66' ' ' VAL . 0.3 OUTLIER -131.93 112.76 12.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.278 179.08 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.786 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 4.4 p -124.84 154.35 41.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.37 0.605 . . . . 0.0 112.596 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.999 HG13 HG13 ' B' ' 57' ' ' ILE . 12.3 mm -131.15 113.22 23.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.234 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.907 HG12 ' HB ' ' A' ' 38' ' ' ILE . 5.5 p -105.02 128.99 58.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.019 0.437 . . . . 0.0 111.184 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.741 ' HA3' ' CD1' ' A' ' 62' ' ' PHE . . . -157.99 170.13 34.8 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.995 -0.621 . . . . 0.0 111.783 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -132.84 34.82 3.6 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.956 0.408 . . . . 0.0 110.887 -179.792 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.521 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 1.1 t-20 169.63 27.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.68 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 1.006 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 20.7 p90 -115.52 -169.83 1.65 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.891 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.35 95.6 0.17 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.916 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.865 ' HA ' HD11 ' B' ' 57' ' ' ILE . 20.0 p -80.99 140.5 35.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.979 0.419 . . . . 0.0 111.539 -179.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.816 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 71.8 t80 -149.13 93.23 2.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.283 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.797 HG21 ' CD2' ' A' ' 86' ' ' PHE . 4.1 m -133.1 149.35 31.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.702 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.748 HG23 HG21 ' B' ' 53' ' ' THR . 1.6 t -79.58 147.31 32.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.679 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 1.006 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -100.92 155.03 18.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.22 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.665 ' HG3' ' OG ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -129.65 -82.48 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.045 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.567 ' C ' ' H ' ' A' ' 72' ' ' HIS . 36.2 m -66.0 -107.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.941 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.571 ' HG3' ' HG3' ' A' ' 13' ' ' MET . 0.0 OUTLIER -69.87 31.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.9 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 1.006 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 1.1 m80 56.61 -91.36 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.636 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.771 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 161.59 -174.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.718 179.756 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.867 HG13 ' HB3' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -154.92 131.76 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.265 -179.986 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.533 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 2.3 t80 -120.61 133.39 55.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.071 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.851 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -151.66 164.73 36.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.94 0.4 . . . . 0.0 111.113 -179.516 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.604 ' O ' ' HD1' ' A' ' 77' ' ' TYR . 4.0 t80 -122.92 92.53 3.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.964 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.084 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.8 mm? -48.12 166.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.692 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -24.47 -54.93 0.05 OUTLIER Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.99 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.72 12.15 3.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.693 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.684 HG12 ' H ' ' A' ' 82' ' ' ALA . 21.8 t -129.58 179.64 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.502 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.684 ' H ' HG12 ' A' ' 81' ' ' VAL . . . -141.19 143.51 34.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.726 0.298 . . . . 0.0 110.67 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.77 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -130.96 125.78 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.739 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.965 HD21 HG12 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -113.12 96.98 6.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.115 179.51 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.771 ' O ' ' HB2' ' A' ' 73' ' ' PHE . 1.7 mp -95.6 128.89 42.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.892 0.377 . . . . 0.0 111.494 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.797 ' CD2' HG21 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -159.84 119.67 2.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.989 179.493 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.809 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -111.69 149.67 31.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.047 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.694 ' HB2' ' HE1' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -111.44 18.59 19.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.326 0.584 . . . . 0.0 110.587 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.376 -1.236 . . . . 0.0 112.485 -179.958 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.839 0.352 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -153.11 166.85 31.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 56.17 86.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.06 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -178.84 4.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.038 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.76 ' O ' ' HB1' ' B' ' 6' ' ' ALA . 0.0 OUTLIER -47.74 118.51 2.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.763 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.926 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.67 -179.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.765 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.724 HG23 ' O ' ' B' ' 77' ' ' TYR . 41.2 t -145.06 63.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.935 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.5 OUTLIER -33.49 148.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.442 -179.845 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' B' ' 8' ' ' ILE . 13.9 mmtt -148.21 -1.86 0.54 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.929 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.45 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 0.3 OUTLIER -175.22 83.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.761 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.952 ' HB1' HG13 ' B' ' 74' ' ' ILE . . . -123.7 113.51 18.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.831 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.875 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 94.7 m-20 -110.65 37.7 2.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.984 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 17' ' ' MET . 17.3 ttp -125.68 170.97 11.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.075 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.727 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.44 141.84 14.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.827 179.877 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.638 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 17.7 mp0 -50.89 -60.53 2.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.896 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.529 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 1.3 mt-10 -54.24 -20.73 7.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.536 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -82.67 -34.57 27.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.866 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 1.004 ' HA ' HD11 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.69 -36.97 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.823 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.759 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 3.2 mp0 -77.06 -40.72 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.529 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 5.0 m-20 -67.05 -34.01 76.77 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.468 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.839 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -65.5 -46.65 78.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.034 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.859 HG12 ' HB1' ' B' ' 6' ' ' ALA . 73.3 t -56.28 -42.38 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.242 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.759 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 24.1 mt-10 -60.6 -39.4 87.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.333 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.52 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 4.1 t -66.51 -32.97 74.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 110.097 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.784 ' HB1' HG22 ' B' ' 83' ' ' ILE . . . -73.22 -32.15 64.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.873 ' HA ' HD12 ' B' ' 29' ' ' LEU . 90.1 m -72.43 -39.53 67.78 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.312 -1.313 . . . . 0.0 109.639 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.771 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 80.7 mm-40 -58.11 -46.1 86.13 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.315 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 1.053 ' HB2' ' HA ' ' B' ' 38' ' ' ILE . . . -67.93 -29.09 68.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.843 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 1.059 HD13 ' HG ' ' B' ' 78' ' ' LEU . 4.5 mt -65.36 -57.11 9.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.664 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -34.48 71.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.803 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.771 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 16.0 mmtt -79.83 -28.78 40.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.676 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.697 ' HH ' ' HD1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -167.56 133.63 2.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.183 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -97.47 26.25 5.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.564 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.982 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 10.3 mm -95.84 109.98 23.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.743 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.891 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 0.5 OUTLIER -29.73 -70.37 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.116 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.599 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -50.67 -56.52 11.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.916 0.388 . . . . 0.0 110.557 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.982 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -43.99 -64.17 0.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.541 179.806 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 1.053 ' HA ' ' HB2' ' B' ' 28' ' ' ALA . 7.0 mt -45.49 -52.96 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.671 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.683 ' CA ' HG12 ' B' ' 58' ' ' VAL . . . -51.4 -39.16 56.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.816 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -66.89 -63.38 1.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.573 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.697 ' HD1' ' HH ' ' B' ' 32' ' ' TYR . 0.5 OUTLIER -42.84 -47.34 5.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.518 179.672 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.761 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 32.5 mt -61.74 -70.44 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.393 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.753 ' HB3' ' CE2' ' A' ' 65' ' ' TYR . 0.5 OUTLIER -36.49 -58.98 0.68 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.478 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 1.6 tttm -51.38 -42.28 61.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.54 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.754 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -70.45 -42.25 71.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.358 -179.458 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.839 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -63.56 -35.78 81.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.014 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.775 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -68.84 -46.43 68.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.698 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.566 ' HZ1' ' HA ' ' B' ' 48' ' ' LYS . 0.1 OUTLIER -78.16 -25.49 47.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.219 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.754 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -89.7 -16.9 29.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.122 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.741 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 53.6 m-85 -125.93 -72.01 0.67 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.455 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.741 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 52.7 t30 160.09 108.55 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.775 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 62.4 Cg_exo -35.02 157.23 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.562 2.174 . . . . 0.0 112.63 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.748 HG21 HG23 ' A' ' 67' ' ' THR . 0.3 OUTLIER -121.92 120.13 33.56 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 122.809 0.444 . . . . 0.0 110.611 -0.005 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.827 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 33.8 m95 -88.69 155.29 19.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.278 0.561 . . . . 0.0 111.491 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.783 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 3.7 m-70 -136.03 99.11 4.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.265 -0.88 . . . . 0.0 108.888 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.949 ' HB3' HD12 ' B' ' 85' ' ' LEU . 2.3 m -108.08 151.51 25.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.999 HG13 HG13 ' A' ' 57' ' ' ILE . 18.1 mm -135.46 108.15 8.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.629 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.954 HG13 ' HB ' ' B' ' 38' ' ' ILE . 2.1 p -111.1 125.78 68.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -178.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.752 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -146.63 -96.1 0.18 Allowed Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.196 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.641 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 16.5 ptt85 169.27 -27.82 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 120.813 0.339 . . . . 0.0 111.088 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.475 ' O ' ' OD1' ' B' ' 61' ' ' ASN . 24.4 t-20 -160.47 42.41 0.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 1.006 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.6 p90 -96.65 -165.02 1.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.875 0.369 . . . . 0.0 110.784 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.518 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -141.08 111.57 0.72 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.795 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.933 ' HB2' HD13 ' A' ' 57' ' ' ILE . 88.4 p -101.1 128.32 47.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.084 0.469 . . . . 0.0 111.596 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.79 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 48.0 t80 -136.41 67.62 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.143 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.997 HG11 HD11 ' A' ' 57' ' ' ILE . 10.3 m -103.28 169.86 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.376 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.716 ' HB ' ' CD2' ' A' ' 55' ' ' HIS . 59.6 m -117.34 80.64 1.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.71 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.808 ' HE1' ' HB ' ' B' ' 70' ' ' THR . 59.7 t-80 -57.37 -129.19 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.945 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.735 ' H ' ' HD1' ' B' ' 68' ' ' HIS . 6.7 pt-20 161.32 -47.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.027 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.808 ' HB ' ' HE1' ' B' ' 68' ' ' HIS . 4.0 m -87.73 -111.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.613 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.568 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -56.97 4.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.66 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.875 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 0.1 OUTLIER 72.4 -74.77 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.64 0.257 . . . . 0.0 110.549 -179.879 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.772 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 4.3 p90 154.94 173.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.215 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 1.004 HD11 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -147.17 119.28 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.922 0.391 . . . . 0.0 111.246 179.511 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.751 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 1.4 t80 -103.79 136.55 43.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.351 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.935 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.38 129.19 5.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.975 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.724 ' O ' HG23 ' B' ' 7' ' ' VAL . 2.4 t80 -97.16 113.38 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.059 ' HG ' HD13 ' B' ' 29' ' ' LEU . 0.9 OUTLIER -69.47 170.54 10.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.42 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.506 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.54 -41.55 0.01 OUTLIER Glycine 0 C--N 1.33 0.242 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.958 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.521 ' N ' ' O ' ' B' ' 78' ' ' LEU . 51.6 mt-30 -154.02 35.4 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.88 HG11 ' N ' ' B' ' 82' ' ' ALA . 58.6 t -151.16 170.91 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.024 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.88 ' N ' HG11 ' B' ' 81' ' ' VAL . . . -128.61 154.13 46.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.299 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.784 HG22 ' HB1' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -142.71 126.57 14.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.418 . . . . 0.0 111.56 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.97 HD23 HG12 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -118.57 95.71 4.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.201 179.439 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.949 HD12 ' HB3' ' B' ' 56' ' ' CYS . 1.7 mp -93.65 123.74 37.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.368 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.667 ' CZ ' ' HB ' ' B' ' 66' ' ' VAL . 0.1 OUTLIER -162.53 123.23 2.48 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.558 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.827 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 2.2 ptmt -100.59 143.78 30.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.956 0.407 . . . . 0.0 110.974 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.492 ' H ' ' CD2' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -107.23 18.92 21.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.321 0.581 . . . . 0.0 110.48 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.4 -1.222 . . . . 0.0 112.431 -179.946 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.5 mmt . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.849 0.356 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.517 ' HB2' ' H ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -104.29 -112.59 0.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.913 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.517 ' H ' ' HB2' ' A' ' 2' ' ' CYS . 3.9 p30 31.81 47.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.88 0.372 . . . . 0.0 110.683 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.668 ' O ' HG12 ' A' ' 22' ' ' VAL . 23.7 mmt180 -46.78 -50.69 17.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.237 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 6' ' ' ALA . 8.1 mmmm 60.55 -167.28 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.652 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.094 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 56.72 144.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.216 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.572 HG13 ' HE2' ' A' ' 9' ' ' LYS . 21.4 t -107.69 78.29 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.969 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.981 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -46.38 154.42 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.051 0.453 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.572 ' HE2' HG13 ' A' ' 7' ' ' VAL . 5.6 mmtt -138.53 -19.4 1.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.27 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.511 HD21 ' HA ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -168.27 98.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.535 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.852 ' HB3' ' NE2' ' A' ' 18' ' ' GLN . . . -112.13 75.47 0.92 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.748 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.752 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 7.4 m-20 -75.17 38.54 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.251 0.548 . . . . 0.0 109.618 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.869 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -136.26 172.12 13.47 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.626 -179.113 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.869 ' N ' ' HG2' ' A' ' 13' ' ' MET . 8.3 t -54.24 134.74 44.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.285 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.755 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -51.36 -78.95 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.337 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.494 ' HG2' ' N ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -43.33 -27.42 0.25 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.979 0.419 . . . . 0.0 110.352 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.805 ' HG2' ' CG ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -78.71 -35.06 45.45 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.047 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.852 ' NE2' ' HB3' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -74.58 -31.62 62.12 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.818 0.342 . . . . 0.0 110.398 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.652 ' HG2' ' NE ' ' A' ' 4' ' ' ARG . 1.6 mt-30 -72.28 -40.9 67.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 178.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -66.65 -29.67 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.529 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.717 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -66.58 -45.61 78.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.049 179.081 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 1.015 HG13 ' HB2' ' A' ' 6' ' ' ALA . 84.7 t -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.477 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.406 ' OE2' ' OD1' ' A' ' 3' ' ' ASP . 13.2 mm-40 -58.15 -36.84 73.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.953 0.406 . . . . 0.0 110.081 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.8 t -67.37 -32.68 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.047 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.78 ' C ' HD13 ' A' ' 29' ' ' LEU . . . -73.56 -40.27 64.06 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 1.028 ' HA ' HD12 ' A' ' 29' ' ' LEU . 87.1 m -64.55 -37.71 88.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.271 -1.332 . . . . 0.0 109.43 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -61.26 -43.09 99.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.493 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.831 ' HB1' HG22 ' A' ' 38' ' ' ILE . . . -76.69 -14.5 59.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.996 179.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 1.028 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.4 mt -82.53 -44.99 15.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.777 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -34.51 64.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.241 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.493 ' CB ' ' CE1' ' A' ' 32' ' ' TYR . 3.1 mttm -79.13 -28.65 42.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.649 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.633 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.68 149.07 27.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.94 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -116.37 33.53 5.5 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.053 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.941 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 5.7 mm -112.95 107.86 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.964 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.901 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 35.5 mp0 -29.95 -74.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.904 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.483 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -43.54 -59.46 2.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.691 179.767 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.941 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -45.2 -63.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.544 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.831 HG22 ' HB1' ' A' ' 28' ' ' ALA . 7.5 mt -46.79 -52.22 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.126 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.971 ' HB2' ' HB2' ' B' ' 65' ' ' TYR . . . -54.16 -36.7 63.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.101 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.793 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -66.23 -67.28 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.115 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.606 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -46.14 -39.93 10.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.758 HG13 ' O ' ' A' ' 38' ' ' ILE . 65.6 mt -62.8 -66.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.966 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.872 ' HE3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -46.61 -47.05 20.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.438 ' O ' ' HB3' ' A' ' 47' ' ' ASP . 0.8 OUTLIER -52.85 -63.47 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.666 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 4.5 tp10 -45.61 -58.02 3.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.378 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.717 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 2.1 m-85 -52.93 -39.72 63.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.594 179.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.77 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 3.9 t70 -62.12 -24.96 67.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.345 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.787 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -118.4 4.76 11.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.799 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.62 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -107.74 -14.22 14.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.938 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.793 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 5.6 m-85 -145.51 -63.14 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.24 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.793 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 10.7 p-10 157.0 117.16 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.148 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.77 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 13.8 Cg_endo -56.18 174.82 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.47 2.113 . . . . 0.0 112.22 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.967 HG22 HG22 ' B' ' 67' ' ' THR . 23.4 m -103.66 123.16 46.48 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.14 0.576 . . . . 0.0 110.577 0.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.808 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 51.5 m95 -96.77 126.95 42.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.18 0.514 . . . . 0.0 112.181 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.751 ' CB ' HG13 ' B' ' 66' ' ' VAL . 0.0 OUTLIER -106.82 96.99 6.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.504 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.826 ' HB2' HD11 ' A' ' 85' ' ' LEU . 18.9 p -111.4 147.08 35.99 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.199 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 1.068 HD11 HG12 ' B' ' 66' ' ' VAL . 18.3 mm -133.03 109.67 14.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.304 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.726 HG13 ' N ' ' A' ' 39' ' ' ALA . 3.1 p -109.42 124.62 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 111.796 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.777 ' O ' HG11 ' A' ' 81' ' ' VAL . . . -146.65 -135.76 2.78 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.061 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -160.89 -20.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.749 0.309 . . . . 0.0 111.312 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.697 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 8.8 m-20 -154.91 35.37 0.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.355 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.913 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 11.2 p90 -101.66 -178.29 3.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.71 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.795 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.73 107.59 0.61 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.82 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 1.02 ' HA ' HD13 ' B' ' 57' ' ' ILE . 53.6 p -92.41 130.37 38.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.207 0.527 . . . . 0.0 111.713 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.795 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 48.5 t80 -136.67 72.06 1.42 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.099 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.809 HG13 HD12 ' B' ' 57' ' ' ILE . 5.9 m -122.38 136.53 58.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.294 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.774 HG22 ' O ' ' A' ' 67' ' ' THR . 7.0 t -67.94 116.78 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.972 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.46 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 21.4 p-80 -87.21 162.83 17.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.736 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.71 ' O ' HG21 ' A' ' 70' ' ' THR . 6.3 pt-20 -158.57 -153.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.949 0.404 . . . . 0.0 111.166 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.71 HG21 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 44.06 -92.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.751 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 170.64 21.02 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.659 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.848 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 25.5 m-70 -125.18 61.96 1.18 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.12 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.752 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 7.4 t80 -130.76 97.82 4.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.933 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.863 HG23 ' HE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -115.42 122.88 70.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.804 -179.163 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.588 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 8.0 t80 -114.04 137.11 52.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.299 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.981 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -161.0 173.23 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.183 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.693 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 89.2 t80 -132.87 92.47 3.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.908 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.094 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.1 mm? -42.75 169.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.59 -44.14 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.424 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.443 ' O ' ' OE1' ' A' ' 80' ' ' GLN . 0.9 OUTLIER -148.37 32.62 0.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.777 HG11 ' O ' ' A' ' 59' ' ' GLY . 76.4 t -147.46 171.66 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.65 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.76 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -133.51 144.79 49.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.82 0.343 . . . . 0.0 110.745 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.721 HD12 ' C ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -134.53 124.64 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.077 -179.752 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.773 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 0.9 OUTLIER -112.72 88.34 2.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.556 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.826 HD11 ' HB2' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -93.35 124.19 37.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.472 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.73 ' CE1' ' HB2' ' A' ' 55' ' ' HIS . 2.5 p90 -164.11 129.04 2.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.591 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.793 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.53 161.59 13.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.503 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.737 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -120.22 19.64 12.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 0.0 110.434 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.029 0 CA-C-O 118.39 -1.228 . . . . 0.0 112.556 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.474 ' O ' ' C ' ' B' ' 2' ' ' CYS . 14.3 mtt . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.8 0.333 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.474 ' C ' ' O ' ' B' ' 1' ' ' MET . 0.0 OUTLIER 31.9 76.4 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.991 179.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.72 141.16 53.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.617 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.543 HH11 ' CB ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER 61.19 87.24 0.09 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.682 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.543 ' O ' ' HD2' ' B' ' 5' ' ' LYS . 0.0 OUTLIER -112.02 40.52 2.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.085 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -115.42 -170.92 1.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.336 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.84 HG13 ' HE3' ' B' ' 9' ' ' LYS . 26.8 t -137.98 66.69 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.799 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.9 OUTLIER -37.21 157.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.132 0.491 . . . . 0.0 110.663 -179.829 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.84 ' HE3' HG13 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -154.44 -11.4 0.13 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.201 179.722 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.519 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.2 OUTLIER -166.8 100.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.433 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.931 ' HB2' HG13 ' B' ' 74' ' ' ILE . . . -128.77 136.77 50.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.019 0.438 . . . . 0.0 111.599 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.572 ' CB ' ' HD2' ' B' ' 68' ' ' HIS . 21.1 t70 -132.63 28.7 4.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.774 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.83 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 13.5 ttp -123.98 151.58 43.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.856 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.778 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 2.1 m -36.52 141.39 0.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.942 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' B' ' 18' ' ' GLN . 11.9 mt-10 -46.94 -66.45 0.4 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.184 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.681 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -50.93 -30.57 15.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.773 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.769 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.13 -40.75 74.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.743 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.778 ' HG2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -66.78 -28.67 68.58 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.849 0.357 . . . . 0.0 110.469 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.681 ' HG2' ' O ' ' B' ' 16' ' ' GLU . 2.6 pt20 -77.36 -42.55 36.08 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.61 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 1.1 m-20 -69.9 -25.03 63.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.79 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.86 ' HG ' HG21 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -70.87 -51.52 25.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.196 179.278 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.83 HG13 ' HB1' ' B' ' 6' ' ' ALA . 60.9 t -57.17 -42.39 79.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.244 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.541 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 8.7 mt-10 -61.42 -38.88 88.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.077 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.443 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 65.9 m -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.964 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.843 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -70.23 -33.63 71.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.742 ' HA ' HD12 ' B' ' 29' ' ' LEU . 1.4 m -66.84 -40.76 88.05 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.43 -1.259 . . . . 0.0 109.487 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 5.6 mt-30 -56.57 -44.92 81.46 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.562 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.856 ' HB1' ' HD1' ' B' ' 41' ' ' HIS . . . -80.25 -15.23 57.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.565 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.742 HD12 ' HA ' ' B' ' 26' ' ' THR . 5.7 mt -82.57 -35.71 26.9 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.653 ' OE1' ' HD2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -88.07 -30.19 20.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.188 -179.717 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.653 ' HD2' ' OE1' ' B' ' 30' ' ' GLU . 1.7 mptt -84.39 -9.75 58.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.834 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.613 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.1 OUTLIER -151.1 -150.09 0.33 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.975 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.514 HD21 ' HA ' ' B' ' 33' ' ' ASN . 0.0 OUTLIER 177.87 28.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.609 179.843 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 1.028 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.8 mm -117.8 106.4 19.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.509 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.795 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 2.3 mp0 -29.67 -62.65 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.924 0.392 . . . . 0.0 110.731 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.5 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -55.1 -51.97 64.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.017 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 1.028 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.5 m-20 -54.44 -61.3 2.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.828 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.86 HG22 HD13 ' B' ' 42' ' ' ILE . 2.5 mt -45.78 -48.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.008 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.663 ' HB2' ' CB ' ' A' ' 65' ' ' TYR . . . -62.42 -34.2 76.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.795 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -62.4 -62.91 1.43 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.034 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.856 ' HD1' ' HB1' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -53.72 -54.13 42.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.939 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.86 HD13 HG22 ' B' ' 38' ' ' ILE . 73.7 mt -44.06 -66.65 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.277 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.701 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 13.2 tttp -42.82 -50.97 5.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.903 0.382 . . . . 0.0 110.917 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.631 ' HZ3' ' HB3' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -55.9 -45.9 78.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.219 -179.79 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.663 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.0 mt-10 -68.09 -34.88 77.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.15 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.781 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -72.32 -32.63 66.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.991 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.707 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 5.1 m-20 -71.31 -38.0 71.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.915 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.438 ' HZ1' ' HG2' ' B' ' 48' ' ' LYS . 0.1 OUTLIER -90.48 -23.67 20.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.688 -179.584 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.663 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.4 OUTLIER -86.03 -20.53 28.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.359 -179.562 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.557 ' HD2' ' O ' ' B' ' 46' ' ' PHE . 12.7 m-85 -132.09 -66.82 0.69 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.617 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.492 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 3.4 t-20 158.93 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.395 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.707 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 20.8 Cg_endo -60.3 171.61 3.11 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.307 2.005 . . . . 0.0 112.333 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.764 HG22 HG23 ' A' ' 67' ' ' THR . 62.9 m -104.74 131.57 52.02 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 122.917 0.487 . . . . 0.0 111.052 0.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.809 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 46.2 m95 -102.2 157.58 16.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.591 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.767 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 10.2 m-70 -128.91 99.57 5.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.755 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.908 ' HB3' HD11 ' B' ' 85' ' ' LEU . 1.8 m -106.26 128.26 53.84 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 1.02 HD13 ' HA ' ' A' ' 64' ' ' SER . 17.0 mm -125.32 101.38 8.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.501 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.744 ' HB ' HG22 ' B' ' 83' ' ' ILE . 2.7 p -108.77 126.24 65.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 0.0 111.85 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.747 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.08 -105.29 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.795 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.795 ' HG3' HD21 ' B' ' 61' ' ' ASN . 0.4 OUTLIER 170.91 -33.26 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.67 0.271 . . . . 0.0 111.194 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.795 HD21 ' HG3' ' B' ' 60' ' ' ARG . 7.0 m-80 -145.02 46.72 1.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.125 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.913 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 21.3 p90 -111.0 -173.54 2.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.904 0.383 . . . . 0.0 110.76 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.901 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -138.0 98.53 0.26 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.778 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.844 ' HA ' HD12 ' A' ' 57' ' ' ILE . 1.2 p -86.81 121.99 30.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.223 0.535 . . . . 0.0 111.591 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.971 ' HB2' ' HB2' ' A' ' 39' ' ' ALA . 21.8 t80 -129.14 75.53 1.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 1.068 HG12 HD11 ' A' ' 57' ' ' ILE . 28.4 m -123.48 164.62 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.336 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.967 HG22 HG22 ' A' ' 53' ' ' THR . 5.3 t -82.91 128.17 34.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.669 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.62 ' H ' ' HD1' ' B' ' 68' ' ' HIS . 1.8 p-80 -104.11 118.57 36.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.534 ' O ' ' HB ' ' B' ' 70' ' ' THR . 0.8 OUTLIER -123.29 168.73 12.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.707 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.584 HG22 ' CD2' ' B' ' 72' ' ' HIS . 29.0 m 76.13 -100.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.716 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.622 ' O ' ' HA ' ' B' ' 13' ' ' MET . 2.3 ttpt 173.33 38.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.798 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.83 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 3.2 m-70 -138.66 46.87 1.97 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.782 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 4.8 t80 -120.69 87.67 2.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.404 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.931 HG13 ' HB2' ' B' ' 11' ' ' ALA . 1.2 tt -105.48 144.91 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.045 0.45 . . . . 0.0 111.632 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.8 OUTLIER -134.1 131.18 38.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.195 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.799 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 9.7 p90 -158.54 161.7 37.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.991 0.425 . . . . 0.0 111.258 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.669 ' O ' HG21 ' B' ' 7' ' ' VAL . 8.0 t80 -122.23 111.02 16.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.411 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.085 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.41 169.97 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.767 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -23.39 -45.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 113.15 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.696 ' O ' HG21 ' B' ' 81' ' ' VAL . 14.3 tt0 -151.4 36.74 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.752 0.311 . . . . 0.0 110.937 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.768 HG11 ' N ' ' B' ' 82' ' ' ALA . 86.0 t -152.12 170.18 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.184 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.768 ' N ' HG11 ' B' ' 81' ' ' VAL . . . -133.85 149.94 51.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.843 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -140.11 131.56 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.188 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.762 HD22 HG12 ' B' ' 57' ' ' ILE . 2.0 tp -121.34 88.58 2.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.908 HD11 ' HB3' ' B' ' 56' ' ' CYS . 1.3 mp -92.93 124.54 36.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.069 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.771 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 12.1 p90 -162.72 132.83 4.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.349 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.799 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -93.82 151.87 19.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.534 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.666 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.1 OUTLIER -113.99 19.72 16.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.314 0.578 . . . . 0.0 110.17 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.397 -1.224 . . . . 0.0 112.436 -179.866 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.525 ' HB2' ' HE2' ' A' ' 1' ' ' MET . 20.4 mtm . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.831 0.348 . . . . 0.0 111.239 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.1 m 57.74 108.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.815 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.547 ' HB3' HH11 ' A' ' 4' ' ' ARG . 1.2 m-20 -149.1 -145.83 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.088 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.547 HH11 ' HB3' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -33.65 -60.11 0.38 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.206 -179.881 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.726 ' O ' HD11 ' A' ' 78' ' ' LEU . 6.1 tptm 52.74 35.83 19.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.793 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.062 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -136.5 175.3 9.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.212 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.504 ' O ' ' HE3' ' A' ' 9' ' ' LYS . 95.9 t -137.31 77.94 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.758 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.782 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 1.2 mp -32.78 148.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.334 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.757 ' HB2' ' CD2' ' A' ' 75' ' ' TYR . 5.0 mmtp -129.45 -14.19 4.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.847 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.43 ' HB3' ' H ' ' A' ' 11' ' ' ALA . 1.7 t30 -164.09 -91.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.483 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.991 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 70.09 -173.96 0.18 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.577 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.596 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 2.8 t0 166.62 28.51 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.471 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.64 ' HG3' ' H ' ' A' ' 14' ' ' SER . 15.4 ttp -113.76 171.58 7.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.674 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.905 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 1.9 m -48.35 129.17 15.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.877 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.469 ' H ' ' HG2' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -34.39 -79.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.795 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.627 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 2.1 mm-40 -46.07 -22.89 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.905 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -76.14 -39.89 53.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.549 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.665 ' HG2' ' O ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -68.47 -38.16 80.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.495 179.625 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.43 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 1.0 OUTLIER -72.98 -36.74 67.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.566 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.627 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.4 t0 -66.78 -39.58 87.86 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.84 179.233 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.998 ' HB2' HD23 ' A' ' 85' ' ' LEU . 1.1 p -60.35 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.74 178.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.802 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 40.1 t -52.74 -50.24 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.303 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 54.2 mt-10 -54.3 -46.78 72.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.22 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.438 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 20.0 m -59.29 -37.31 77.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.034 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.952 ' HB3' HG23 ' A' ' 83' ' ' ILE . . . -69.04 -28.32 66.45 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.514 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.8 m -72.93 -39.43 66.28 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.4 -1.273 . . . . 0.0 109.54 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.683 ' O ' ' HD3' ' A' ' 31' ' ' LYS . 6.3 mm-40 -56.79 -43.22 80.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.406 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.9 ' HB3' ' HB3' ' A' ' 41' ' ' HIS . . . -75.99 -29.94 58.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.178 179.039 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.657 ' HG ' ' CG2' ' A' ' 38' ' ' ILE . 3.1 mt -72.71 -30.52 64.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.212 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -95.96 -16.11 21.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.831 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.683 ' HD3' ' O ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -92.5 -23.93 18.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.551 ' HE1' ' HA ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -163.49 134.84 4.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.754 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -96.11 39.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.894 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.709 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 40.2 mm -117.59 102.16 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.001 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.643 ' OE2' ' HD3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -22.25 -89.43 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.423 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -37.03 -42.88 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.727 179.967 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.709 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 24.2 t0 -57.96 -56.54 20.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.517 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.764 HG22 ' HB1' ' A' ' 28' ' ' ALA . 9.8 mt -52.04 -45.72 41.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.649 ' HB3' HG12 ' A' ' 58' ' ' VAL . . . -61.87 -45.72 92.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.794 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -56.2 -64.34 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.286 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.9 ' HB3' ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -38.8 -52.68 1.72 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.02 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.751 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 16.9 mt -55.91 -68.17 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.203 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.617 ' HE2' ' C ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -37.34 -63.03 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.204 -179.848 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.438 ' HA ' ' HZ3' ' A' ' 43' ' ' LYS . 4.9 tttt -43.92 -57.19 3.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.418 . . . . 0.0 111.037 -179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.586 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -53.51 -57.03 12.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.205 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.781 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -55.03 -34.82 63.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.541 ' HB2' ' CE ' ' A' ' 43' ' ' LYS . 17.6 t70 -73.54 -20.88 60.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.57 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.719 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -121.38 10.53 10.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.586 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.8 OUTLIER -128.18 3.35 5.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.547 -179.431 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.569 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 95.7 m-85 -147.07 -63.12 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.509 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 18.8 p-10 161.56 110.87 0.01 OUTLIER Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.109 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.498 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 86.1 Cg_exo -45.96 151.06 1.55 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.311 2.008 . . . . 0.0 112.578 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.651 ' O ' ' HB2' ' A' ' 87' ' ' LYS . 95.1 m -118.74 136.17 54.11 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.162 0.585 . . . . 0.0 110.353 -0.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.787 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 65.3 m95 -101.48 144.8 29.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.27 0.557 . . . . 0.0 111.993 -179.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.75 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.2 OUTLIER -130.26 103.39 6.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.847 178.854 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.805 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.37 162.64 18.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.404 0.621 . . . . 0.0 112.496 -178.176 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.931 HG23 ' HA ' ' B' ' 64' ' ' SER . 26.2 mm -131.77 172.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.977 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.855 ' H ' HG21 ' A' ' 57' ' ' ILE . 7.3 p -169.33 114.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.946 0.403 . . . . 0.0 111.563 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.557 ' HA2' ' CG ' ' A' ' 35' ' ' GLU . . . -141.07 -140.06 3.78 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.801 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.643 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -162.78 6.09 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.427 ' O ' ' OE2' ' B' ' 35' ' ' GLU . 0.6 OUTLIER -179.99 32.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.76 0.314 . . . . 0.0 111.205 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.943 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -101.12 -169.1 1.65 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.097 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.585 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.41 93.98 0.17 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.849 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.807 ' HB2' HD12 ' A' ' 84' ' ' LEU . 0.2 OUTLIER -82.72 134.15 35.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 0.0 111.498 -179.244 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.781 ' HB2' ' HB1' ' B' ' 39' ' ' ALA . 19.7 t80 -143.34 65.29 1.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.256 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.757 ' CG1' ' HB3' ' B' ' 55' ' ' HIS . 2.8 m -113.94 153.7 15.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.357 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.783 HG21 HG23 ' B' ' 53' ' ' THR . 3.4 t -62.57 -162.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.951 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.63 ' HD1' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -156.85 150.16 24.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.915 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.707 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -143.48 175.03 10.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 179.894 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.59 ' C ' ' H ' ' A' ' 72' ' ' HIS . 3.5 m 42.37 -114.57 0.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.662 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.752 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 4.2 mmtm -69.87 24.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.754 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 51.1 m-70 62.54 -88.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.69 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.756 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.2 OUTLIER 162.58 -169.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.604 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.991 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -161.12 141.37 3.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.443 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.757 ' CD2' ' HB2' ' A' ' 9' ' ' LYS . 7.8 t80 -131.54 139.47 49.25 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.787 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.802 ' CE2' ' HA ' ' A' ' 22' ' ' VAL . 0.2 OUTLIER -161.55 176.42 11.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.845 0.355 . . . . 0.0 111.097 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.739 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 42.4 t80 -135.48 97.21 3.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.201 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.062 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -60.3 -169.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.457 179.695 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.561 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -61.73 93.08 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.07 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.561 ' HB2' ' O ' ' A' ' 79' ' ' GLY . 4.8 mm100 71.1 15.9 6.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.117 0.484 . . . . 0.0 110.268 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.873 HG11 ' N ' ' A' ' 82' ' ' ALA . 55.2 t -136.84 164.91 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.775 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.873 ' N ' HG11 ' A' ' 81' ' ' VAL . . . -138.37 151.87 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.69 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.952 HG23 ' HB3' ' A' ' 25' ' ' ALA . 0.2 OUTLIER -140.41 126.42 21.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.884 0.374 . . . . 0.0 111.398 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.861 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 0.9 OUTLIER -112.02 93.37 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.998 HD23 ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -92.21 147.44 22.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.173 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.715 ' CE2' HG12 ' B' ' 66' ' ' VAL . 5.9 p90 179.33 119.02 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.182 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.787 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 2.3 ptmt -101.12 150.97 22.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.724 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.5 OUTLIER -103.7 20.68 17.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.242 0.544 . . . . 0.0 110.911 -179.847 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.545 ' HA3' ' OG1' ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.349 -1.251 . . . . 0.0 112.364 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.6 mmm . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.805 0.336 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.549 ' O ' ' NH1' ' B' ' 4' ' ' ARG . 12.1 t -107.66 67.74 0.69 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.746 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.671 ' O ' ' HD3' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -108.98 177.75 4.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.017 -179.99 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.671 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 0.0 OUTLIER -175.01 -65.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.831 -179.987 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.743 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.6 OUTLIER 32.49 40.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.261 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.038 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -131.78 -176.27 3.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.278 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.557 ' N ' ' O ' ' B' ' 77' ' ' TYR . 45.0 t -145.73 72.41 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.922 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.789 HD11 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -33.15 147.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 110.583 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.548 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 0.5 OUTLIER -134.35 -12.39 2.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.686 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.408 ' HB2' ' O ' ' B' ' 9' ' ' LYS . 0.1 OUTLIER 173.6 103.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.826 -179.719 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.673 ' HB2' ' HG2' ' B' ' 18' ' ' GLN . . . -130.4 154.12 48.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.454 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.928 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 26.6 m-20 -146.98 27.51 1.06 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.339 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.89 ' SD ' ' HG3' ' B' ' 71' ' ' LYS . 10.7 ttp -108.26 178.02 4.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.598 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.757 ' H ' ' HG3' ' B' ' 13' ' ' MET . 3.5 m -58.76 128.6 38.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.806 0.336 . . . . 0.0 111.015 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.662 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . 1.6 mt-10 -33.35 -70.06 0.08 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.759 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 3.4 mm-40 -55.22 -26.51 39.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.272 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.764 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 38.5 mmm -72.56 -34.67 67.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.822 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.953 ' HB3' HD13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.41 -48.62 39.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.022 0.439 . . . . 0.0 110.663 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.774 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 2.2 mm100 -68.3 -23.43 64.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.78 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER -79.11 -34.89 43.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.86 179.166 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.796 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 0.2 OUTLIER -65.96 -41.49 91.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.883 179.075 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.763 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 95.4 t -63.85 -50.17 78.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.262 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.774 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 39.7 mt-10 -51.94 -40.91 61.56 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.491 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.757 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 48.6 t -66.7 -37.59 85.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.321 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.979 ' HA ' HD12 ' B' ' 42' ' ' ILE . . . -69.56 -28.8 66.29 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.535 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 4.7 m -70.82 -43.31 68.88 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 114.329 -1.305 . . . . 0.0 109.513 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.757 ' HG3' ' HA ' ' B' ' 24' ' ' CYS . 6.1 mt-30 -53.5 -47.3 69.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.717 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.966 ' HB2' HG22 ' B' ' 38' ' ' ILE . . . -76.21 -20.19 57.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.632 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.835 HD11 ' HG ' ' B' ' 78' ' ' LEU . 5.9 mt -74.89 -39.89 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.272 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.47 -30.56 27.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.382 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.542 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 7.2 mttt -82.04 -33.34 30.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.0 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.625 ' CG ' ' HE1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -144.44 157.12 44.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.721 HD21 HD11 ' B' ' 34' ' ' ILE . 0.3 OUTLIER -123.54 29.36 6.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.214 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 1.086 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 4.0 mm -107.68 108.0 24.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.585 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 0.3 OUTLIER -29.79 -71.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.132 -179.512 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.424 ' H ' ' HG2' ' B' ' 36' ' ' LYS . 0.5 OUTLIER -50.03 -54.67 18.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.866 0.365 . . . . 0.0 110.647 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 1.086 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.3 m-20 -46.11 -64.65 0.7 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.966 HG22 ' HB2' ' B' ' 28' ' ' ALA . 4.8 mt -44.56 -56.01 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.253 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.781 ' HB1' ' HB2' ' A' ' 65' ' ' TYR . . . -55.88 -38.32 70.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.471 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.748 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -57.59 -58.83 6.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.218 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.625 ' HE1' ' CG ' ' B' ' 32' ' ' TYR . 0.1 OUTLIER -58.07 -33.93 69.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.13 -179.82 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.979 HD12 ' HA ' ' B' ' 25' ' ' ALA . 62.5 mt -66.05 -69.51 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.55 ' HB3' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -45.11 -37.28 4.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.962 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.593 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 43.3 mmtt -71.14 -51.67 23.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 111.023 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.6 mt-10 -62.69 -25.58 68.23 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.947 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.796 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -75.61 -47.49 26.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.617 179.912 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.71 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.9 OUTLIER -64.94 -24.68 67.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.304 179.642 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.7 ' HE2' ' C ' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -89.85 -42.76 11.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.625 179.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.674 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.8 tttp -83.0 -14.17 54.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.05 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.78 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 58.0 m-85 -128.88 -71.38 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.435 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.714 HD21 ' HD2' ' B' ' 52' ' ' PRO . 1.9 t-20 156.22 119.22 0.0 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.18 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.714 ' HD2' HD21 ' B' ' 51' ' ' ASN . 19.0 Cg_endo -59.23 168.9 4.27 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 122.495 2.13 . . . . 0.0 112.661 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.783 HG23 HG21 ' A' ' 67' ' ' THR . 1.7 t -108.5 125.31 51.66 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 122.885 0.474 . . . . 0.0 110.54 0.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.812 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 42.8 m95 -95.92 168.56 10.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.584 0.707 . . . . 0.0 112.107 -179.195 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.757 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 8.4 m-70 -131.09 96.19 3.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.584 178.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.726 ' SG ' HG21 ' B' ' 42' ' ' ILE . 78.9 m -104.44 122.49 45.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.201 0.524 . . . . 0.0 112.116 -178.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.755 HD12 ' CD2' ' A' ' 84' ' ' LEU . 7.7 mt -127.77 109.16 19.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.382 179.015 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.848 HG13 ' HB ' ' B' ' 38' ' ' ILE . 1.6 p -111.04 118.65 57.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.321 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.685 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -138.79 -126.15 2.37 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.889 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.735 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -169.7 10.03 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.687 0.28 . . . . 0.0 111.147 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.735 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.1 OUTLIER 163.64 32.82 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.994 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.943 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.2 p90 -82.86 173.08 12.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.023 0.439 . . . . 0.0 111.004 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.94 76.88 0.32 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.894 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.931 ' HA ' HG23 ' A' ' 57' ' ' ILE . 53.1 p -72.52 122.2 20.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 0.0 111.415 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.854 ' H ' HD12 ' A' ' 57' ' ' ILE . 23.3 t80 -133.92 77.39 1.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.309 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.849 HG11 HD11 ' A' ' 57' ' ' ILE . 6.1 m -115.14 163.89 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.497 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.624 ' O ' HG21 ' B' ' 67' ' ' THR . 19.7 m -95.62 73.33 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.464 179.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.636 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 2.9 p-80 -46.57 179.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.4 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.636 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -179.49 -177.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.467 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.558 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 56.13 -120.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.818 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.89 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.72 17.42 0.07 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.943 0.402 . . . . 0.0 110.672 179.82 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.928 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 7.0 m-70 68.53 -90.36 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.827 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.727 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 1.0 OUTLIER 157.87 -164.68 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.566 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.953 HD13 ' HB3' ' B' ' 18' ' ' GLN . 0.2 OUTLIER -162.76 116.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.504 ' OH ' ' CZ ' ' B' ' 62' ' ' PHE . 1.1 t80 -107.02 134.65 49.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.29 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.789 ' HB3' HD11 ' B' ' 8' ' ' ILE . 2.9 p90 -152.35 165.34 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.086 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.577 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 26.7 t80 -126.33 108.95 11.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.038 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -69.86 170.47 11.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.763 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.477 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.97 -37.34 0.01 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.917 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.699 ' O ' HG22 ' B' ' 81' ' ' VAL . 4.6 tt0 -158.5 41.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.745 0.307 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.91 HG12 ' N ' ' B' ' 82' ' ' ALA . 69.8 t -157.79 164.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.009 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.91 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -133.44 111.74 10.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.662 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.656 ' CG1' HD22 ' B' ' 78' ' ' LEU . 0.1 OUTLIER -101.33 133.37 44.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.973 0.416 . . . . 0.0 111.482 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.739 HD13 ' HG ' ' B' ' 64' ' ' SER . 0.1 OUTLIER -119.74 103.92 9.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.156 179.628 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.727 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 4.3 mp -107.22 117.11 33.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.52 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.683 ' HE2' HD21 ' B' ' 84' ' ' LEU . 25.1 p90 -153.34 138.39 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.925 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.812 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 5.3 mtpm? -100.65 159.63 15.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 111.207 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.601 ' HB2' ' HE2' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -98.43 19.33 14.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.818 -179.891 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . 0.409 ' CA ' ' OG1' ' B' ' 70' ' ' THR . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.424 -1.209 . . . . 0.0 112.567 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.6 tpp . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.728 0.299 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.592 ' HB3' ' OD1' ' A' ' 3' ' ' ASP . 0.1 OUTLIER -139.06 -64.36 0.51 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.901 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.592 ' OD1' ' HB3' ' A' ' 2' ' ' CYS . 0.0 OUTLIER -120.98 -156.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 3' ' ' ASP . 2.3 mpp_? 66.67 -77.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.895 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.446 ' C ' HD13 ' A' ' 78' ' ' LEU . 0.1 OUTLIER 56.5 29.25 15.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.73 -179.865 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -123.9 -178.82 4.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.205 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 77' ' ' TYR . 93.3 t -133.92 73.86 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.009 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.831 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -39.59 155.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.267 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.783 ' HA ' ' HZ2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -146.41 -10.03 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.567 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.442 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER 179.11 97.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.632 179.813 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 1.013 ' HB2' HG13 ' A' ' 74' ' ' ILE . . . -127.44 94.95 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.666 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 72' ' ' HIS . 88.1 m-20 -90.33 30.93 1.05 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.285 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.893 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.1 OUTLIER -116.59 166.83 11.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.644 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.874 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -45.65 122.94 3.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.797 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.609 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -38.01 -73.58 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.948 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.471 ' OE1' ' HA ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -44.52 -28.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.754 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.893 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -73.02 -43.63 61.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.812 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.743 ' CB ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -59.9 -36.39 76.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.725 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.461 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 6.7 mt-30 -75.43 -39.77 58.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.137 0.494 . . . . 0.0 109.923 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.41 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -68.48 -29.01 67.53 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.41 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.821 ' HG ' HG23 ' A' ' 74' ' ' ILE . 0.1 OUTLIER -68.53 -45.92 70.95 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.785 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.682 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 17.4 t -56.55 -44.19 80.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.211 178.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 62.0 mt-10 -59.61 -41.58 90.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.269 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.742 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 53.6 t -65.08 -34.69 79.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.257 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.648 ' HA ' HD13 ' A' ' 42' ' ' ILE . . . -73.14 -32.98 65.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.945 ' HA ' HD11 ' A' ' 29' ' ' LEU . 23.5 m -70.22 -36.9 74.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.565 178.583 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.794 ' HB3' ' NE2' ' A' ' 41' ' ' HIS . 0.2 OUTLIER -62.31 -42.28 99.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.758 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.864 ' HB3' ' HA ' ' A' ' 38' ' ' ILE . . . -69.88 -28.94 66.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.859 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.945 HD11 ' HA ' ' A' ' 26' ' ' THR . 1.5 mt -71.12 -58.7 3.3 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.813 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -36.61 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.859 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.772 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 15.1 mmtp -79.45 -35.77 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.887 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.605 ' HE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -153.56 152.11 30.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.886 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.918 ' HA ' HD11 ' A' ' 38' ' ' ILE . 4.7 m120 -128.46 40.37 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.534 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.603 ' O ' ' N ' ' A' ' 36' ' ' LYS . 33.2 mm -107.5 49.26 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.232 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.837 ' HG3' ' HA2' ' A' ' 59' ' ' GLY . 0.0 OUTLIER 34.72 -89.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.378 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.603 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -41.33 -46.9 3.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.987 0.422 . . . . 0.0 110.52 179.338 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.587 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 61.0 t0 -54.19 -61.13 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.81 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.918 HD11 ' HA ' ' A' ' 33' ' ' ASN . 3.5 mt -48.12 -50.72 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.078 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 1.03 ' HB2' ' HB2' ' B' ' 65' ' ' TYR . . . -52.13 -51.47 57.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.791 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -52.79 -51.31 61.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.698 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.86 ' HB3' ' HB2' ' A' ' 28' ' ' ALA . 0.6 OUTLIER -52.14 -47.0 65.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.55 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.742 ' HA ' ' SG ' ' A' ' 24' ' ' CYS . 37.1 mt -55.17 -71.88 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.189 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.766 ' HB3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -37.61 -55.2 1.14 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.997 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -44.26 -62.35 1.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.13 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.751 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 1.3 tp10 -55.54 -62.04 1.95 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.091 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.815 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.1 m-85 -41.67 -49.61 4.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.949 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.765 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 1.6 m-20 -56.58 -39.74 74.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.1 6.54 43.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.248 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.751 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -108.89 -20.72 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.098 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.718 ' HH ' ' HZ1' ' A' ' 49' ' ' LYS . 14.1 m-85 -140.62 -58.55 0.52 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.417 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.65 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 0.4 OUTLIER 159.21 118.37 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.292 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.765 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 29.3 Cg_endo -62.39 171.37 5.48 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 122.561 2.174 . . . . 0.0 112.407 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.781 HG22 HG23 ' B' ' 67' ' ' THR . 20.6 m -104.9 134.46 47.97 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 122.981 0.512 . . . . 0.0 110.648 0.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.814 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.6 m95 -105.7 145.45 31.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.49 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.851 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 5.6 m170 -121.69 101.8 7.81 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.764 ' HB3' HD11 ' A' ' 85' ' ' LEU . 8.6 p -107.66 146.79 31.56 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 1.005 HD12 ' HB2' ' B' ' 64' ' ' SER . 29.6 mm -134.47 107.37 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.548 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.778 HG12 ' HB3' ' A' ' 39' ' ' ALA . 7.2 p -107.86 116.35 51.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.545 -179.466 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.837 ' HA2' ' HG3' ' A' ' 35' ' ' GLU . . . -134.97 -134.11 3.35 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.192 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.71 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -167.36 11.12 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 120.827 0.346 . . . . 0.0 111.137 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.71 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 29.1 t-20 165.55 31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.894 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 3.0 p90 -91.32 -175.28 4.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.781 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.652 ' N ' ' HD1' ' A' ' 62' ' ' PHE . . . -138.41 101.32 0.32 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.87 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.914 ' HB2' HD11 ' B' ' 57' ' ' ILE . 87.6 p -87.45 144.88 26.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.196 0.522 . . . . 0.0 111.72 -179.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.723 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 22.9 t80 -152.2 64.95 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.803 HG12 HD12 ' B' ' 57' ' ' ILE . 27.2 m -104.8 160.73 5.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.6 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.489 ' OG1' ' OG1' ' B' ' 53' ' ' THR . 2.3 m -87.0 -17.79 32.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.96 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.828 ' HB3' ' HB2' ' A' ' 86' ' ' PHE . 6.4 p-80 35.55 -157.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.714 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER 167.6 -155.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.91 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.838 ' HG1' ' HA2' ' A' ' 89' ' ' GLY . 0.2 OUTLIER 41.65 -98.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.671 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.571 ' O ' ' HB2' ' A' ' 13' ' ' MET . 1.4 mmtp -91.27 32.83 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.712 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.728 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.0 OUTLIER 52.99 -88.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.95 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.728 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 28.0 p90 165.46 -174.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.007 0.432 . . . . 0.0 111.125 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 1.013 HG13 ' HB2' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -154.03 129.69 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.887 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.582 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -117.05 137.23 52.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.496 179.644 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.831 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -162.46 163.7 27.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.902 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.769 ' HE1' ' HA ' ' A' ' 80' ' ' GLN . 6.3 t80 -130.55 103.64 6.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.156 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.0 mm? -60.21 -178.82 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.833 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.02 -53.56 0.08 OUTLIER Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.54 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.769 ' HA ' ' HE1' ' A' ' 77' ' ' TYR . 0.3 OUTLIER -147.77 34.47 0.84 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.014 0.435 . . . . 0.0 110.415 179.468 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.915 HG13 ' H ' ' A' ' 82' ' ' ALA . 91.5 t -143.69 167.61 12.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.912 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.915 ' H ' HG13 ' A' ' 81' ' ' VAL . . . -131.68 151.97 51.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.542 179.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.633 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -138.84 134.06 42.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.995 0.426 . . . . 0.0 111.375 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.735 HD23 ' HB2' ' A' ' 64' ' ' SER . 0.3 OUTLIER -122.5 91.65 3.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.957 179.532 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.764 HD11 ' HB3' ' A' ' 56' ' ' CYS . 2.1 mp -93.71 125.28 38.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.63 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.828 ' HB2' ' HB3' ' A' ' 68' ' ' HIS . 27.9 p90 -158.95 122.54 3.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.814 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 40.3 mtpt -80.4 165.44 22.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.615 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.851 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -115.37 19.93 15.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.243 0.544 . . . . 0.0 110.634 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.838 ' HA2' ' HG1' ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.085 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.405 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.416 ' H1 ' ' H ' ' B' ' 2' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.875 0.369 . . . . 0.0 111.179 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.446 ' HA ' ' OE2' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -130.77 40.72 3.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.875 179.88 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -18.09 38.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.112 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.847 HH11 ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER 47.1 21.87 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.997 0.427 . . . . 0.0 110.723 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.608 ' O ' ' HB2' ' B' ' 6' ' ' ALA . 0.1 OUTLIER -42.67 129.66 4.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.051 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 0.739 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.93 165.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.88 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.657 HG13 ' HE2' ' B' ' 9' ' ' LYS . 71.7 t -132.17 66.98 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.945 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.948 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.08 153.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.185 0.517 . . . . 0.0 110.731 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.759 ' N ' HG22 ' B' ' 8' ' ' ILE . 0.9 OUTLIER -154.01 -4.95 0.17 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.565 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.1 OUTLIER -173.12 86.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.361 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 1.043 ' HB3' HG13 ' B' ' 74' ' ' ILE . . . -121.24 84.71 2.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.947 -179.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.521 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 0.3 OUTLIER -75.9 40.57 0.2 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.408 179.205 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.706 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 16.5 ttp -132.11 166.21 22.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.784 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.0 m -52.25 143.56 14.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.929 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.491 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 10.9 mt-10 -48.31 -65.82 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.993 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.74 -29.25 17.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.852 -179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.735 ' HE1' ' CH2' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -72.98 -32.04 64.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.784 ' HG2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -76.1 -34.87 59.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.674 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.652 ' HG3' ' NH1' ' B' ' 4' ' ' ARG . 2.6 mp0 -75.8 -38.28 58.35 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.36 -30.85 66.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.652 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.765 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 77.5 p -67.77 -44.48 77.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.819 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.705 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 81.4 t -59.48 -50.19 80.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.477 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.446 ' OE2' ' HA ' ' B' ' 2' ' ' CYS . 3.7 mm-40 -55.0 -40.64 70.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.305 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 9.1 m -65.61 -35.24 80.24 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.813 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.846 ' HA ' HD13 ' B' ' 42' ' ' ILE . . . -71.8 -30.28 65.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.74 ' HA ' HD12 ' B' ' 29' ' ' LEU . 34.3 m -72.68 -39.35 67.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.593 178.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.657 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -55.99 -45.34 79.02 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.237 178.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.649 ' O ' ' HD1' ' B' ' 32' ' ' TYR . . . -76.13 -22.17 55.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.042 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.74 HD12 ' HA ' ' B' ' 26' ' ' THR . 4.6 mt -75.46 -34.17 60.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.651 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -90.0 -25.12 21.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.931 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.782 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.8 mmtm -85.2 -27.62 26.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.531 179.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.782 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -151.81 163.39 39.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.464 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.431 ' CG ' ' O ' ' B' ' 33' ' ' ASN . 28.4 t-20 -128.39 39.25 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.085 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.965 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 18.2 mm -120.54 104.41 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.9 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.717 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 0.8 OUTLIER -29.64 -66.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.045 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.759 ' HG3' HG23 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -51.75 -50.43 60.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.791 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.965 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.6 OUTLIER -53.84 -61.99 1.94 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.905 0.383 . . . . 0.0 110.44 179.695 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.943 HG22 HD12 ' B' ' 42' ' ' ILE . 5.0 mt -44.46 -48.65 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.017 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.647 ' HB3' HG13 ' B' ' 58' ' ' VAL . . . -58.98 -43.63 91.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.152 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.723 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -55.58 -64.51 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.921 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.612 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -51.31 -57.17 9.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.943 HD12 HG22 ' B' ' 38' ' ' ILE . 87.8 mt -43.52 -62.67 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.667 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 4.6 tttt -53.93 -30.67 47.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.576 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.503 ' HB2' ' O ' ' B' ' 41' ' ' HIS . 3.9 mttt -68.38 -48.55 64.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.207 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.466 ' O ' ' CB ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -68.11 -42.16 80.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.665 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.765 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -63.26 -33.39 75.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.892 -179.922 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.788 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.7 OUTLIER -71.11 -49.22 46.6 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.96 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.14 -21.67 46.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.549 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.79 ' O ' ' HD3' ' B' ' 49' ' ' LYS . 0.4 OUTLIER -90.53 -30.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.609 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.546 ' HD2' ' HA ' ' B' ' 46' ' ' PHE . 87.4 m-85 -115.52 -64.48 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.75 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 1.2 t-20 158.94 114.37 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.183 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.788 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 85.1 Cg_exo -47.3 152.83 2.06 Favored 'Trans proline' 0 CA--C 1.533 0.426 0 C-N-CA 122.284 1.99 . . . . 0.0 112.659 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.727 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 8.9 t -122.82 126.0 46.54 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 122.921 0.488 . . . . 0.0 111.036 0.116 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.98 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 44.5 m95 -90.62 117.16 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.747 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.781 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -96.07 109.16 21.62 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.497 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.778 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 0.5 OUTLIER -123.52 149.91 44.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.354 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.914 HD11 ' HB2' ' A' ' 64' ' ' SER . 23.2 mm -130.76 109.79 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.73 ' HA ' ' O ' ' B' ' 82' ' ' ALA . 2.8 p -110.27 125.67 67.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.93 0.395 . . . . 0.0 111.232 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.782 ' O ' HG11 ' B' ' 81' ' ' VAL . . . -138.37 -128.28 2.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.965 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.744 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.6 OUTLIER -165.3 5.78 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.707 0.289 . . . . 0.0 111.613 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.744 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 2.0 t-20 164.32 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.81 0.338 . . . . 0.0 110.974 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.894 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -87.4 -171.15 3.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.043 0.449 . . . . 0.0 110.845 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.606 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -136.97 77.58 0.34 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.884 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 1.005 ' HB2' HD12 ' A' ' 57' ' ' ILE . 5.8 p -70.55 142.21 51.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.031 0.444 . . . . 0.0 111.23 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 1.03 ' HB2' ' HB2' ' A' ' 39' ' ' ALA . 48.8 t80 -146.04 76.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.356 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.835 HG11 ' HB3' ' A' ' 55' ' ' HIS . 4.4 m -125.02 131.08 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.272 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.781 HG23 HG22 ' A' ' 53' ' ' THR . 2.6 t -78.31 130.61 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.024 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.498 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.1 OUTLIER -72.65 177.45 4.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.564 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.7 OUTLIER -163.97 38.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.247 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.437 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 178.99 -113.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.134 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.534 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -158.63 25.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.792 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.978 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 17.1 m80 -124.58 44.82 2.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.84 ' HE1' HD13 ' B' ' 84' ' ' LEU . 8.1 t80 -124.33 90.51 3.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.545 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 1.043 HG13 ' HB3' ' B' ' 11' ' ' ALA . 0.8 OUTLIER -106.74 132.04 55.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.047 0.451 . . . . 0.0 111.508 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.853 ' HD1' HD12 ' B' ' 84' ' ' LEU . 18.3 t80 -119.78 134.04 55.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.818 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.948 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.1 OUTLIER -161.37 166.84 26.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.984 0.421 . . . . 0.0 111.16 -179.672 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.625 ' HH ' ' HA ' ' B' ' 80' ' ' GLN . 6.4 t80 -128.06 111.7 13.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.894 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 0.739 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.62 166.52 18.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.458 179.763 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.43 -60.85 0.1 Allowed Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.502 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.625 ' HA ' ' HH ' ' B' ' 77' ' ' TYR . 0.0 OUTLIER -132.81 36.15 3.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.288 179.36 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.782 HG11 ' O ' ' B' ' 59' ' ' GLY . 68.9 t -152.15 169.78 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.566 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.73 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -137.02 147.49 46.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.983 0.42 . . . . 0.0 110.998 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.749 HG22 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -133.26 131.7 58.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.074 -179.812 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.862 HD22 HG12 ' B' ' 57' ' ' ILE . 3.3 tp -123.83 83.73 2.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.701 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.734 HD12 ' CB ' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -87.45 131.85 34.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.007 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.796 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -160.98 125.6 3.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.98 ' HG3' ' HA ' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -105.54 143.75 33.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.737 179.879 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.781 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -91.47 19.47 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.251 0.548 . . . . 0.0 110.735 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . 0.625 ' O ' ' HE2' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.447 -1.196 . . . . 0.0 112.511 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.586 ' C ' ' SG ' ' A' ' 2' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.789 0.328 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.586 ' SG ' ' C ' ' A' ' 1' ' ' MET . 0.2 OUTLIER -165.29 83.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.797 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 169.61 166.53 0.05 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.841 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.552 ' NH2' ' NE2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -57.08 -76.32 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.066 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.502 ' HA ' ' HD2' ' A' ' 5' ' ' LYS . 0.4 OUTLIER 66.05 28.61 10.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.683 -179.695 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.055 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.61 169.19 12.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.704 HG11 ' HE2' ' A' ' 9' ' ' LYS . 47.6 t -120.96 82.8 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.929 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -55.18 136.52 17.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.117 0.484 . . . . 0.0 110.639 -179.885 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.704 ' HE2' HG11 ' A' ' 7' ' ' VAL . 0.5 OUTLIER -125.19 -12.85 6.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.041 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.6 ' O ' ' N ' ' A' ' 75' ' ' TYR . 29.9 t30 -176.51 122.85 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.356 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.871 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -149.89 91.03 1.74 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.789 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -75.32 28.52 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.139 0.495 . . . . 0.0 109.841 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.874 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 2.0 ttm -114.14 163.28 15.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.77 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.771 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.2 OUTLIER -56.9 137.78 54.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.618 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.1 mp0 -41.76 -78.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.458 ' H ' ' HG2' ' A' ' 16' ' ' GLU . 2.8 mm-40 -40.02 -27.29 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.779 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.822 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.4 -42.44 53.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.849 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.871 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -64.85 -32.86 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.894 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.552 ' NE2' ' NH2' ' A' ' 4' ' ' ARG . 91.2 mt-30 -76.28 -42.04 46.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.157 0.503 . . . . 0.0 109.717 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.699 ' HB3' ' HH ' ' A' ' 50' ' ' TYR . 5.3 m-20 -70.49 -30.73 67.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.669 179.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.806 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 21.9 t -66.84 -45.1 79.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.806 ' HA ' ' CZ ' ' A' ' 76' ' ' PHE . 46.8 t -59.98 -46.74 93.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.31 -40.74 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.071 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.795 ' HA ' ' HG3' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -66.23 -38.45 87.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.079 179.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.917 ' HB3' HG21 ' A' ' 83' ' ' ILE . . . -68.61 -26.93 65.61 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.531 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.3 m -73.84 -40.23 63.46 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.795 178.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.795 ' HG3' ' HA ' ' A' ' 24' ' ' CYS . 7.0 mt-30 -56.87 -44.34 82.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.75 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.717 ' CB ' HG22 ' A' ' 38' ' ' ILE . . . -79.45 -21.83 44.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.544 179.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.987 HD21 HG13 ' A' ' 81' ' ' VAL . 6.5 mt -73.25 -44.09 60.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.084 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -81.48 -29.64 33.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.075 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.493 ' CB ' ' CE1' ' A' ' 32' ' ' TYR . 2.4 mttm -77.77 -36.13 50.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.757 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.627 ' CD1' ' N ' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -150.33 151.8 33.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.815 179.693 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.509 ' HA ' ' CD1' ' A' ' 38' ' ' ILE . 1.6 m-80 -125.88 35.44 4.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.074 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.952 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 36.2 mm -98.44 32.09 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.099 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.619 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 4.1 mp0 41.24 -86.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.376 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.615 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.75 -50.98 5.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.307 179.26 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.952 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.9 OUTLIER -53.99 -54.24 41.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.323 179.368 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.717 HG22 ' CB ' ' A' ' 28' ' ' ALA . 4.7 mt -54.33 -59.08 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.829 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.765 ' N ' HG13 ' A' ' 58' ' ' VAL . . . -48.74 -40.38 28.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.779 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.805 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -54.66 -67.59 0.25 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.81 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.62 ' ND1' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -49.05 -45.72 43.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.76 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.835 HG21 HD12 ' A' ' 85' ' ' LEU . 58.7 mt -49.96 -48.8 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.969 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.631 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 8.4 tmtt? -66.81 -59.64 3.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.52 ' HZ3' ' HG2' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -40.04 -57.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.958 0.409 . . . . 0.0 110.971 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.678 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 1.6 tp10 -60.93 -38.25 85.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.263 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.806 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -69.19 -27.23 65.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.085 -179.651 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.81 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -90.3 -13.95 34.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 0.0 110.414 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.627 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -111.39 -8.8 14.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.611 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.718 ' HD2' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -106.56 -23.1 12.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.216 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.718 ' CE1' ' HD2' ' A' ' 49' ' ' LYS . 3.9 m-85 -123.94 -62.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.518 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.483 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 1.3 t30 156.19 121.98 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.973 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.81 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 31.4 Cg_endo -63.03 172.26 5.17 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.646 2.231 . . . . 0.0 112.686 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.553 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 36.0 m -102.08 133.72 46.47 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 122.819 0.448 . . . . 0.0 110.492 -0.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.764 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 56.0 m95 -104.23 140.23 38.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.286 0.565 . . . . 0.0 112.147 -179.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.874 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.6 OUTLIER -130.43 99.83 5.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.212 -0.903 . . . . 0.0 108.811 178.767 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.799 ' HB2' HD11 ' A' ' 85' ' ' LEU . 0.5 OUTLIER -116.89 167.81 10.79 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -177.648 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.888 HD13 ' HA ' ' B' ' 64' ' ' SER . 17.5 mm -135.14 156.49 39.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.789 178.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.786 ' HA ' ' O ' ' A' ' 82' ' ' ALA . 10.0 p -158.9 109.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.935 0.397 . . . . 0.0 111.629 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.594 ' O ' HG11 ' A' ' 81' ' ' VAL . . . -139.44 -130.76 2.75 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.019 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.611 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -164.04 -28.9 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 120.737 0.303 . . . . 0.0 111.416 -179.678 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.437 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 53.0 t30 -152.88 45.98 0.69 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.964 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 1.021 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -103.0 -163.26 0.98 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.973 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.806 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.43 90.84 0.15 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.073 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.96 ' HA ' HG12 ' B' ' 57' ' ' ILE . 3.3 p -78.28 147.05 34.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.407 . . . . 0.0 111.22 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.817 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 13.2 t80 -154.6 62.61 0.67 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.645 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.796 HG22 HD23 ' A' ' 84' ' ' LEU . 4.5 m -124.59 140.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.324 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.748 HG21 ' CG2' ' B' ' 53' ' ' THR . 15.2 t -86.16 149.91 24.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.706 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.414 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -78.3 -157.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.96 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.1 OUTLIER -140.86 -51.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.761 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 t -141.01 -60.37 0.49 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.868 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.761 ' HG2' ' C ' ' A' ' 70' ' ' THR . 0.0 OUTLIER -157.03 -136.88 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.776 -179.933 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.861 ' HA ' ' HG3' ' A' ' 13' ' ' MET . 2.9 m-70 31.75 35.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.874 ' N ' ' HB2' ' A' ' 13' ' ' MET . 6.5 t80 -116.73 100.69 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.748 0.309 . . . . 0.0 110.735 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.901 HG22 ' HE1' ' A' ' 76' ' ' PHE . 2.4 tt -117.19 153.17 18.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.969 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 10' ' ' ASN . 10.0 t80 -149.83 93.23 2.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.66 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.929 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -113.78 -176.17 2.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.33 -179.51 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.607 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 31.1 t80 -143.0 91.03 2.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.811 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.055 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -49.4 174.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.927 -179.945 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.461 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.19 -59.95 0.26 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.577 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.439 HE21 ' HB3' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -133.57 34.05 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.753 0.311 . . . . 0.0 110.729 179.927 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.987 HG13 HD21 ' A' ' 29' ' ' LEU . 96.2 t -148.97 164.22 4.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.272 -179.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.855 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -129.95 153.18 48.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.59 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.917 HG21 ' HB3' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -144.5 118.49 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.373 . . . . 0.0 111.039 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.837 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 6.5 tp -107.48 86.55 2.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.835 HD12 HG21 ' A' ' 42' ' ' ILE . 0.2 OUTLIER -87.75 138.69 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.466 -179.868 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.695 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -175.5 125.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.321 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.764 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 53.1 mtpt -82.12 -171.7 3.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.797 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.96 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 2.2 m -139.6 19.87 2.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.305 0.574 . . . . 0.0 110.353 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.347 -1.252 . . . . 0.0 112.469 -179.884 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.849 0.356 . . . . 0.0 111.207 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.697 ' O ' ' HB2' ' B' ' 3' ' ' ASP . 0.4 OUTLIER -167.47 -160.64 0.37 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.864 179.958 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.697 ' HB2' ' O ' ' B' ' 2' ' ' CYS . 17.4 m-20 79.61 103.49 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.533 ' O ' HG11 ' B' ' 22' ' ' VAL . 0.0 OUTLIER 54.39 -98.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.973 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.743 ' O ' HD12 ' B' ' 78' ' ' LEU . 0.2 OUTLIER 59.78 108.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.032 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.21 -168.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.633 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.726 HG13 ' HE2' ' B' ' 9' ' ' LYS . 10.5 t -157.03 73.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.901 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.849 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -38.16 150.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.726 ' HE2' HG13 ' B' ' 7' ' ' VAL . 63.2 mmtt -146.9 -3.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.492 ' HA ' HD21 ' B' ' 10' ' ' ASN . 0.0 OUTLIER 179.02 83.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.147 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.849 ' HB3' ' NE2' ' B' ' 18' ' ' GLN . . . -109.63 72.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.794 -179.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.752 ' HB2' ' HD2' ' B' ' 73' ' ' PHE . 0.6 OUTLIER -73.52 33.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.752 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.932 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -129.56 172.05 11.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.716 -178.782 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.857 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.98 133.21 32.83 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.94 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.762 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 3.2 mp0 -51.64 -69.43 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.408 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -52.21 -29.83 24.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.517 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.794 ' HG2' ' CG ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -75.17 -32.79 61.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.968 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.849 ' NE2' ' HB3' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -76.06 -28.59 57.69 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.854 0.359 . . . . 0.0 110.352 179.271 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.492 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 5.2 mm100 -72.87 -40.29 65.76 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.527 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 8.7 m-20 -68.33 -30.59 69.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.17 178.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.801 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -62.97 -48.7 77.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.976 178.97 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.795 ' HA ' ' CZ ' ' B' ' 76' ' ' PHE . 95.5 t -55.25 -51.86 51.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.006 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 7.9 mt-10 -54.77 -36.34 64.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.862 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -36.18 70.41 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.704 ' HA ' HD12 ' B' ' 42' ' ' ILE . . . -70.65 -23.14 62.46 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.735 ' HA ' HD13 ' B' ' 29' ' ' LEU . 6.5 m -78.59 -42.2 29.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.599 178.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.769 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -54.04 -46.54 71.91 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.59 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.881 ' HB2' ' HA ' ' B' ' 38' ' ' ILE . . . -69.73 -36.77 76.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.005 178.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.735 HD13 ' HA ' ' B' ' 26' ' ' THR . 5.8 mt -58.27 -53.0 63.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.026 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.608 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.769 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 11.0 mmmt -75.99 -25.68 56.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.3 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.513 ' CG ' ' C ' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -171.92 133.51 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.868 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -92.76 26.58 2.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.043 0.449 . . . . 0.0 110.601 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.642 ' HB ' ' CB ' ' B' ' 37' ' ' ASP . 42.8 mm -96.39 103.57 14.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.688 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 1.004 ' HG3' ' HA2' ' B' ' 59' ' ' GLY . 0.2 OUTLIER -30.05 -70.46 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.535 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -48.15 -53.77 15.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.806 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.642 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 18.3 t0 -48.77 -62.17 1.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.63 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.881 ' HA ' ' HB2' ' B' ' 28' ' ' ALA . 16.6 mt -44.12 -50.78 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.047 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.813 ' HB2' HG11 ' B' ' 58' ' ' VAL . . . -54.58 -47.54 73.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.984 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.817 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -60.01 -50.83 72.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.626 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.8 ' CD2' ' HB1' ' B' ' 28' ' ' ALA . 1.0 OUTLIER -52.9 -50.63 63.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.718 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.704 HD12 ' HA ' ' B' ' 25' ' ' ALA . 19.2 mt -59.97 -70.5 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.641 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.707 ' HD2' ' CE2' ' A' ' 65' ' ' TYR . 0.6 OUTLIER -38.54 -33.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.93 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.431 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 18.2 tttp -68.92 -60.45 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.034 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.743 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 3.0 mm-40 -62.29 -24.8 67.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.881 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.801 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -76.73 -38.81 53.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.605 179.759 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.629 ' HB2' ' HD3' ' B' ' 52' ' ' PRO . 0.6 OUTLIER -66.11 -35.59 80.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.714 179.791 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.468 ' HB3' ' HE2' ' B' ' 48' ' ' LYS . 3.0 mmmm -88.6 -32.51 18.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.743 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -76.35 -25.44 54.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.894 179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.769 ' CD1' ' HE2' ' B' ' 17' ' ' MET . 26.0 m-85 -130.45 -68.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.718 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 1.4 t30 155.02 119.2 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.188 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.629 ' HD3' ' HB2' ' B' ' 47' ' ' ASP . 20.7 Cg_endo -60.4 175.73 1.03 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.326 2.018 . . . . 0.0 112.346 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.795 ' O ' ' HB3' ' B' ' 87' ' ' LYS . 2.0 m -100.51 131.44 46.43 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.951 0.5 . . . . 0.0 110.547 0.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.806 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 64.6 m95 -103.14 100.86 10.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.007 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.751 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 20.5 m170 -73.45 94.37 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.761 ' HB2' HD11 ' B' ' 85' ' ' LEU . 0.5 OUTLIER -111.22 154.28 24.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.276 0.56 . . . . 0.0 112.148 -177.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.978 ' HB ' HD21 ' B' ' 84' ' ' LEU . 29.9 mt -151.15 110.84 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.71 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.813 HG11 ' HB2' ' B' ' 39' ' ' ALA . 1.4 p -107.03 131.61 56.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.187 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 1.004 ' HA2' ' HG3' ' B' ' 35' ' ' GLU . . . -149.46 -134.06 2.28 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.842 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.438 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 1.5 ptm180 -161.51 1.66 0.06 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 120.704 0.288 . . . . 0.0 111.105 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.496 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 1.2 t-20 174.55 34.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.162 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 1.021 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 54.8 p90 -90.48 174.48 7.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 0.0 110.76 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.619 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -123.02 74.17 0.39 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.035 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.888 ' HA ' HD13 ' A' ' 57' ' ' ILE . 28.4 p -74.35 102.76 4.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.879 0.371 . . . . 0.0 111.087 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.805 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 12.7 t80 -109.47 67.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.939 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.874 HG12 HD12 ' A' ' 57' ' ' ILE . 18.6 m -101.14 165.65 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.026 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.772 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 2.3 m -115.15 95.52 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.973 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.629 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.0 OUTLIER -54.17 175.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.885 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.641 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.4 OUTLIER -168.76 80.02 0.14 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.977 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.58 ' O ' ' HG2' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 163.62 -97.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.901 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.7 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -175.72 16.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.552 179.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.932 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 93.5 m-70 -126.93 69.47 1.27 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.854 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.0 t80 -128.83 75.33 1.63 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.507 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.832 HD12 ' HB2' ' B' ' 18' ' ' GLN . 1.2 tt -91.23 129.38 42.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.376 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.675 ' CD1' ' HB2' ' B' ' 84' ' ' LEU . 17.1 t80 -128.29 87.45 2.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.489 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.849 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 4.8 p90 -109.7 164.27 12.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.24 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.627 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 53.8 t80 -123.38 114.79 20.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.71 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.032 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.57 166.14 19.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.823 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.483 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -30.81 -36.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.66 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -151.33 30.73 0.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.914 0.388 . . . . 0.0 110.777 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.747 HG13 ' O ' ' B' ' 59' ' ' GLY . 42.5 t -146.0 168.84 6.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.915 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.627 ' HA ' ' HA ' ' B' ' 77' ' ' TYR . . . -137.34 109.22 7.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.322 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.707 HG12 HD22 ' B' ' 78' ' ' LEU . 0.9 OUTLIER -101.25 133.78 43.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.239 0.542 . . . . 0.0 112.068 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.978 HD21 ' HB ' ' B' ' 57' ' ' ILE . 0.1 OUTLIER -119.28 132.27 55.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.873 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.789 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 3.2 mp -137.35 101.5 4.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.854 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 12.5 p90 -139.61 123.87 17.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.97 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.795 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -91.8 159.18 15.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.641 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 1.3 m -117.64 19.95 13.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.31 0.576 . . . . 0.0 110.246 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.55 -179.891 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.653 ' HE2' ' HA ' ' A' ' 1' ' ' MET . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.917 0.389 . . . . 0.0 111.104 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -173.37 140.87 0.86 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.774 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.709 ' H ' HH21 ' A' ' 4' ' ' ARG . 47.3 m-20 -116.98 -129.94 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.709 HH21 ' H ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER 70.99 -94.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.748 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.767 ' O ' HD12 ' A' ' 78' ' ' LEU . 0.6 OUTLIER 49.68 45.03 24.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.166 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.042 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -139.09 170.43 15.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.753 HG11 ' HE2' ' A' ' 9' ' ' LYS . 26.3 t -131.15 85.81 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.043 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.844 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -49.32 156.54 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.193 0.521 . . . . 0.0 110.826 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.753 ' HE2' HG11 ' A' ' 7' ' ' VAL . 1.2 mmtp -144.78 -14.93 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.935 179.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.77 77.97 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.396 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.892 ' HB3' HG13 ' A' ' 74' ' ' ILE . . . -101.78 76.33 1.63 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.673 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.497 ' OD2' ' CD2' ' A' ' 68' ' ' HIS . 59.3 t0 -77.93 30.25 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.132 0.491 . . . . 0.0 109.973 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.902 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.4 OUTLIER -121.91 163.34 19.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 -179.481 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.841 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -50.13 128.43 19.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.976 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.744 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.3 mm-40 -37.83 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.022 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.793 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.9 OUTLIER -44.33 -31.1 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.902 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -70.94 -37.01 72.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.249 179.535 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.879 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -68.54 -30.29 69.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.475 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.793 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -76.77 -38.3 54.34 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.44 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.4 -25.75 62.47 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.655 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.802 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -72.96 -50.66 22.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.106 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.76 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 17.2 t -60.15 -38.27 76.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.528 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.717 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 47.5 mt-10 -67.15 -38.66 85.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.897 179.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.5 m -70.18 -34.77 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.606 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.846 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -72.52 -36.38 68.31 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.975 ' HA ' HD12 ' A' ' 29' ' ' LEU . 52.0 m -69.05 -36.5 77.75 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.565 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -61.5 -39.35 90.65 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.479 178.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.99 ' HB3' HG21 ' A' ' 38' ' ' ILE . . . -71.92 -28.75 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.604 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.975 HD12 ' HA ' ' A' ' 26' ' ' THR . 1.2 mt -72.7 -41.39 65.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.81 -32.75 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.152 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.432 ' HB3' ' CE2' ' A' ' 32' ' ' TYR . 1.2 mtpp -86.71 -26.59 24.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.043 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.601 ' HE1' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.18 178.18 10.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.746 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.594 ' HA ' HD11 ' A' ' 38' ' ' ILE . 0.4 OUTLIER -158.39 40.19 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.02 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 1.013 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 42.0 mm -103.61 39.28 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HB3' ' C ' ' B' ' 62' ' ' PHE . 4.5 mp0 43.33 -86.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.252 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.694 ' HZ3' ' HH ' ' B' ' 75' ' ' TYR . 2.9 mtpt -48.82 -33.36 10.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.874 0.369 . . . . 0.0 110.228 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 1.013 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -65.88 -45.66 81.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.264 179.472 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.99 HG21 ' HB3' ' A' ' 28' ' ' ALA . 2.8 mp -65.1 -38.4 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.473 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 1.023 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -61.53 -43.13 99.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.424 179.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.66 ' HB3' ' CE1' ' B' ' 65' ' ' TYR . . . -62.38 -55.76 24.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.284 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.746 ' CD2' ' HB1' ' A' ' 28' ' ' ALA . 0.7 OUTLIER -47.81 -47.08 31.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.461 179.328 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.846 HG12 ' HA ' ' A' ' 25' ' ' ALA . 14.1 mt -67.18 -69.25 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.138 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.612 ' HG3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -43.42 -35.27 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.056 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -66.21 -62.19 1.62 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.821 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.653 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 13.5 mt-10 -52.98 -51.24 62.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.802 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -53.12 -52.14 59.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.787 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -57.43 -27.03 62.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.027 -179.876 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 48' ' ' LYS . 24.1 mmmt -113.94 9.61 17.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.147 -179.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.653 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -121.73 -5.12 9.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.111 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.604 ' CD1' ' HA ' ' A' ' 46' ' ' PHE . 11.5 m-85 -148.56 -61.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.307 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.538 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 1.2 p-10 161.45 117.08 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.445 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.787 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 33.2 Cg_endo -64.23 167.21 15.0 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.449 2.099 . . . . 0.0 112.568 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.745 ' CG2' HG22 ' B' ' 67' ' ' THR . 4.9 t -109.54 122.28 47.07 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.757 0.423 . . . . 0.0 110.773 -0.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.695 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 28.4 m95 -89.7 135.86 33.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.841 -179.304 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.715 ' HB2' ' CD1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -102.21 104.84 15.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.161 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.798 ' HB3' HD12 ' A' ' 85' ' ' LEU . 1.6 m -113.11 125.14 54.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.121 0.486 . . . . 0.0 112.171 -178.148 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.788 ' HB ' HD21 ' A' ' 84' ' ' LEU . 13.4 mt -126.42 99.73 5.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.781 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.833 HG12 ' HB ' ' A' ' 38' ' ' ILE . 3.3 p -99.63 123.54 52.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.996 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.73 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -146.0 -150.69 5.25 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.171 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.744 ' HG3' HH11 ' A' ' 60' ' ' ARG . 0.0 OUTLIER -158.28 13.5 0.19 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.682 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 35.1 t30 174.08 35.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.449 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.923 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -100.06 157.78 16.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.152 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.892 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -114.73 83.75 0.34 Allowed Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.955 ' HA ' HD11 ' B' ' 57' ' ' ILE . 84.5 p -79.78 137.94 37.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.1 0.476 . . . . 0.0 111.75 -178.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 1.003 ' HB2' ' HB2' ' B' ' 39' ' ' ALA . 1.5 t80 -141.35 58.09 1.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.263 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.801 ' HA ' ' HB3' ' B' ' 55' ' ' HIS . 27.5 m -104.94 129.63 57.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.039 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.457 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 5.2 m -81.7 123.76 29.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.54 ' H ' ' HD1' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -71.79 172.92 8.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.613 179.743 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.477 ' O ' ' HB ' ' A' ' 70' ' ' THR . 7.3 pt-20 -169.74 75.09 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.066 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.767 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 1.5 t 165.58 -104.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.767 ' HG3' ' O ' ' A' ' 70' ' ' THR . 17.3 mtmt -171.91 18.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.814 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.737 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 66.5 m-70 -130.56 67.47 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.707 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.674 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 1.8 t80 -133.16 93.42 3.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.597 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.892 HG13 ' HB3' ' A' ' 11' ' ' ALA . 3.2 tt -108.96 122.69 64.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.323 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.753 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 34.9 t80 -116.11 88.51 2.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.453 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.844 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -113.3 168.85 9.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.934 0.397 . . . . 0.0 111.411 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.681 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 10.0 t80 -130.09 100.51 5.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.725 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.042 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.1 mm? -53.95 172.15 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -36.09 -36.57 0.14 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.689 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.635 ' O ' HG23 ' A' ' 81' ' ' VAL . 6.7 tp60 -151.5 41.23 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.915 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 1.017 HG12 HD11 ' A' ' 83' ' ' ILE . 42.1 t -158.6 166.54 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.014 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.681 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -134.33 110.12 9.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 1.017 HD11 HG12 ' A' ' 81' ' ' VAL . 0.3 OUTLIER -99.71 118.1 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.038 0.447 . . . . 0.0 111.597 -179.28 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.788 HD21 ' HB ' ' A' ' 57' ' ' ILE . 1.6 tp -102.74 90.68 3.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.111 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.798 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.6 OUTLIER -99.23 124.62 44.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.478 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.727 ' HZ ' ' HZ ' ' B' ' 86' ' ' PHE . 1.3 p90 -168.57 132.72 1.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.209 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.661 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -92.94 168.2 11.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.847 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.61 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -104.85 19.74 20.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.168 0.509 . . . . 0.0 110.826 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.393 -1.226 . . . . 0.0 112.481 -179.953 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.908 ' HE2' ' HA ' ' B' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.916 0.389 . . . . 0.0 111.219 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.475 ' C ' ' O ' ' B' ' 1' ' ' MET . 1.9 t -32.1 105.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.817 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' B' ' 5' ' ' LYS . 2.1 p30 -141.89 76.64 1.55 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.977 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.51 ' H ' ' HG2' ' B' ' 4' ' ' ARG . 0.3 OUTLIER -39.43 -28.14 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.505 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.656 ' HE3' ' H ' ' B' ' 6' ' ' ALA . 0.0 OUTLIER 57.42 -168.04 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.34 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.101 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 57.94 -178.34 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.514 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.773 ' O ' ' HD2' ' B' ' 9' ' ' LYS . 80.3 t -147.78 75.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.776 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.891 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -44.28 153.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.008 0.432 . . . . 0.0 110.211 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.773 ' HD2' ' O ' ' B' ' 7' ' ' VAL . 0.0 OUTLIER -135.29 -22.92 1.51 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.242 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.549 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 2.2 t-20 -145.74 -104.66 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.998 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.956 ' HB1' ' HA ' ' B' ' 74' ' ' ILE . . . 76.19 129.64 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.08 0.467 . . . . 0.0 112.091 178.828 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.688 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -124.49 35.22 4.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.169 179.094 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.655 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 23.0 ttp -121.28 158.2 28.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.962 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.717 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -38.87 158.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 179.747 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.684 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 13.1 mt-10 -67.17 -57.39 6.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.011 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.524 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.1 OUTLIER -55.75 -24.82 37.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.658 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.655 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -78.35 -43.53 27.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.717 ' HG2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -60.75 -37.79 82.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.923 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -74.74 -42.21 58.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.181 0.515 . . . . 0.0 109.907 179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.645 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -65.19 -31.87 73.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.904 179.1 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.745 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 1.0 OUTLIER -66.01 -49.4 67.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.978 179.172 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.769 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 92.5 t -53.28 -46.52 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.672 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.543 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 5.0 mm-40 -61.94 -35.81 79.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.416 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -70.48 -32.43 69.95 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.794 ' HA ' HG12 ' B' ' 42' ' ' ILE . . . -71.99 -40.59 68.45 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.935 ' HA ' HD13 ' B' ' 29' ' ' LEU . 85.2 m -64.94 -42.51 94.58 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.876 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 23.5 mt-30 -55.1 -46.84 75.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.853 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.765 ' HB2' ' HA ' ' B' ' 38' ' ' ILE . . . -63.45 -32.62 74.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.38 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.935 HD13 ' HA ' ' B' ' 26' ' ' THR . 1.0 OUTLIER -68.51 -51.39 43.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.186 -179.778 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -33.25 71.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.969 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.404 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 13.1 mttt -82.88 -35.09 26.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.77 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.487 ' HE2' ' HB2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -146.64 150.87 36.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.737 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -114.97 32.05 6.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.007 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.95 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.1 mm -114.93 110.97 33.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.82 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.892 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 3.4 mp0 -29.99 -70.79 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.24 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.739 ' HE3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -46.23 -48.25 17.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.738 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.95 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -56.9 -62.16 1.94 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.631 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.774 ' HB ' HG11 ' B' ' 58' ' ' VAL . 4.2 mt -45.82 -45.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 1.003 ' HB2' ' HB2' ' A' ' 65' ' ' TYR . . . -59.35 -55.33 36.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.713 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.787 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -51.02 -45.07 61.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.667 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.756 ' CD2' ' HB1' ' B' ' 28' ' ' ALA . 1.5 t60 -59.1 -50.95 72.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.794 HG12 ' HA ' ' B' ' 25' ' ' ALA . 26.0 mt -60.71 -70.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.288 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.665 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 1.5 ttpt -37.19 -57.14 0.89 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.54 -44.67 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.087 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.548 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.2 OUTLIER -63.8 -33.72 76.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.759 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.745 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -74.67 -36.38 62.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.702 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.778 ' OD2' ' HB3' ' B' ' 52' ' ' PRO . 0.2 OUTLIER -68.82 -35.71 77.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.953 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.463 ' HE3' ' HB3' ' B' ' 48' ' ' LYS . 17.6 mmmt -90.75 -38.76 12.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.774 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.548 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.0 OUTLIER -77.79 -22.42 50.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.887 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.777 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 77.7 m-85 -120.61 -71.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.777 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.5 t-20 158.54 118.68 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.778 ' HB3' ' OD2' ' B' ' 47' ' ' ASP . 10.6 Cg_endo -53.3 167.21 0.86 Allowed 'Trans proline' 0 CA--C 1.534 0.484 0 C-N-CA 122.438 2.092 . . . . 0.0 112.791 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.585 HG21 ' NE2' ' B' ' 55' ' ' HIS . 16.3 m -104.68 131.37 52.19 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.774 0.43 . . . . 0.0 110.55 0.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.773 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 60.4 m95 -105.81 139.36 40.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.358 0.599 . . . . 0.0 111.884 -179.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.825 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.1 98.76 4.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.642 178.662 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.765 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 0.4 OUTLIER -119.87 162.03 19.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.453 0.644 . . . . 0.0 112.485 -177.795 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.955 HD11 ' HA ' ' A' ' 64' ' ' SER . 20.0 mm -127.94 162.31 34.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.43 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.774 HG11 ' HB ' ' B' ' 38' ' ' ILE . 4.9 p -160.24 102.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.833 0.349 . . . . 0.0 111.331 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.701 ' O ' HG12 ' B' ' 81' ' ' VAL . . . -136.73 -123.72 2.27 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.102 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -174.61 -46.15 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.787 0.327 . . . . 0.0 111.2 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m-20 -132.25 52.99 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.235 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.923 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -113.84 -154.08 0.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.909 0.385 . . . . 0.0 110.642 179.792 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.722 ' O ' ' HA ' ' A' ' 57' ' ' ILE . . . -154.53 103.84 0.24 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.676 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.733 ' HA ' HG12 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -96.2 137.9 34.6 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.121 0.486 . . . . 0.0 111.486 -179.205 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 1.023 ' HB2' ' HB3' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -143.83 51.71 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.157 179.6 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.681 ' CB ' ' HB3' ' A' ' 55' ' ' HIS . 4.5 m -99.6 139.9 20.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.44 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.745 HG22 ' CG2' ' A' ' 53' ' ' THR . 2.3 t -76.69 138.4 39.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.483 ' CD2' ' CB ' ' B' ' 12' ' ' ASP . 13.9 p-80 -110.81 159.04 18.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.58 176.71 12.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.657 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.652 ' C ' ' HG2' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 66.42 -92.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.976 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.652 ' HG2' ' C ' ' B' ' 70' ' ' THR . 0.9 OUTLIER 164.97 43.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.934 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.544 ' CG ' ' HD3' ' B' ' 87' ' ' LYS . 89.3 m-70 -134.32 46.86 2.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.717 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.692 ' HD2' ' HB3' ' B' ' 86' ' ' PHE . 1.0 OUTLIER -126.94 139.93 52.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.525 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.956 ' HA ' ' HB1' ' B' ' 11' ' ' ALA . 0.5 OUTLIER -149.64 129.32 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.956 0.408 . . . . 0.0 111.595 179.819 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.694 ' HH ' ' HZ3' ' A' ' 36' ' ' LYS . 8.5 t80 -114.2 133.54 55.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.986 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.891 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.2 OUTLIER -165.23 170.02 15.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.344 -179.506 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.681 ' OH ' ' HA ' ' B' ' 80' ' ' GLN . 5.8 t80 -132.67 116.7 16.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.042 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.101 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 3.7 mm? -69.91 167.04 18.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.535 ' O ' ' HG2' ' B' ' 80' ' ' GLN . . . -28.3 -37.23 0.01 OUTLIER Glycine 0 CA--C 1.519 0.296 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.949 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.681 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 5.3 mt-30 -154.42 38.8 0.44 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.727 0.299 . . . . 0.0 111.08 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.798 HG13 ' N ' ' B' ' 82' ' ' ALA . 53.2 t -158.32 167.9 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.111 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.798 ' N ' HG13 ' B' ' 81' ' ' VAL . . . -124.36 160.45 28.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.662 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.753 HG13 ' CE2' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -147.5 131.6 9.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 0.0 111.409 -179.583 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.851 ' HB3' ' HB ' ' B' ' 57' ' ' ILE . 4.0 tp -122.73 90.92 3.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.818 ' HB2' HG22 ' B' ' 74' ' ' ILE . 0.9 OUTLIER -92.89 140.92 28.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.051 0.453 . . . . 0.0 111.682 -179.216 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.795 ' CE2' HG12 ' A' ' 66' ' ' VAL . 1.4 p90 -177.09 131.86 0.18 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.749 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.773 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.8 OUTLIER -96.73 158.65 15.33 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.56 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.825 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -103.17 19.22 19.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.235 0.54 . . . . 0.0 110.511 179.799 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.424 -179.986 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.858 0.361 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.453 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.0 p -149.63 115.52 5.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 4' ' ' ARG . 3.1 t70 -98.47 -38.01 9.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.968 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' A' ' 3' ' ' ASP . 4.7 mtp180 64.83 35.3 8.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.526 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.568 ' O ' HD12 ' A' ' 78' ' ' LEU . 15.3 tppt? -37.69 122.49 0.96 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.936 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.011 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 156.21 156.95 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.719 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.525 HG12 ' HE2' ' A' ' 9' ' ' LYS . 58.0 t -123.38 78.85 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.006 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.876 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -48.85 164.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.171 0.51 . . . . 0.0 110.636 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.784 ' N ' HG22 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -163.16 -13.47 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.975 179.733 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.572 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -164.52 89.12 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.32 179.863 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.904 ' HB2' HG13 ' A' ' 74' ' ' ILE . . . -126.03 93.43 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.715 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 73' ' ' PHE . 9.1 t70 -85.15 28.98 0.68 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.906 179.007 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.748 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 34.6 ttp -120.28 157.67 28.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.983 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.793 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 2.3 m -41.32 147.36 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.556 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.9 OUTLIER -54.89 -56.29 21.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.248 -179.69 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.907 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.2 OUTLIER -62.29 -27.59 69.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.944 0.402 . . . . 0.0 110.251 179.78 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.755 ' HA ' ' OD2' ' A' ' 20' ' ' ASP . 39.7 mmm -71.29 -30.82 66.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.498 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.835 ' HA ' HD11 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -79.25 -29.03 42.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.212 179.327 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.907 ' HG2' ' HA ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -77.53 -43.95 30.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.652 179.165 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.755 ' OD2' ' HA ' ' A' ' 17' ' ' MET . 4.9 p30 -70.86 -31.05 67.62 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.492 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.756 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.3 t -65.14 -46.26 81.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.041 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.734 HG12 ' HB2' ' A' ' 6' ' ' ALA . 53.0 t -59.51 -46.87 92.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.088 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.698 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 28.7 mt-10 -56.46 -34.25 66.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.863 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.627 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 49.8 t -71.46 -36.53 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.076 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.772 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -71.78 -30.78 65.91 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.481 ' HA ' HD13 ' A' ' 29' ' ' LEU . 27.8 m -71.92 -37.99 69.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.252 -1.34 . . . . 0.0 109.429 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.802 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -59.69 -44.41 93.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.608 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.943 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -71.91 -25.61 61.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.838 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.905 HD12 ' HG ' ' A' ' 78' ' ' LEU . 3.0 mt -72.82 -45.73 56.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.148 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -77.83 -21.88 50.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.802 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 23.9 mmtt -90.04 -26.47 20.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.084 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.451 ' CG ' ' C ' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -166.98 115.22 0.83 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.949 -179.844 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.47 ' OD1' ' O ' ' A' ' 29' ' ' LEU . 28.9 m-20 -81.54 32.79 0.35 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.087 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.804 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 39.7 mm -102.62 101.68 12.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.101 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.523 ' O ' HG11 ' A' ' 58' ' ' VAL . 1.8 mp0 -24.15 -86.96 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.444 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -40.03 -37.11 0.55 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.754 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.804 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -63.15 -62.19 1.87 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.645 179.811 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.954 HG23 HD11 ' A' ' 42' ' ' ILE . 20.8 mt -47.34 -44.22 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.661 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.8 ' N ' HG13 ' A' ' 58' ' ' VAL . . . -58.22 -46.98 84.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.483 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.801 ' HB2' ' CE1' ' B' ' 65' ' ' TYR . . . -57.97 -61.09 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.325 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.767 ' CD2' ' HB3' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -40.98 -58.6 1.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.607 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.954 HD11 HG23 ' A' ' 38' ' ' ILE . 6.1 mt -52.22 -70.94 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.735 ' HD2' ' C ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -38.17 -54.84 1.35 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.031 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.31 -62.74 1.28 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.042 0.448 . . . . 0.0 110.963 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.742 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -52.11 -50.7 61.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.152 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.756 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -57.81 -35.67 71.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.766 ' HA ' ' HD1' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -74.13 -21.16 59.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.39 13.38 10.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.331 -179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.742 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -129.37 6.35 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.39 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CD2' ' CD1' ' A' ' 46' ' ' PHE . 97.2 m-85 -148.61 -65.65 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 0.0 111.225 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.453 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 2.6 t-20 163.34 102.83 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.757 ' HA ' ' OD1' ' A' ' 47' ' ' ASP . 45.8 Cg_exo -36.87 154.49 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.665 2.243 . . . . 0.0 112.711 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.809 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 25.9 m -114.44 140.86 48.36 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.047 0.539 . . . . 0.0 110.369 -0.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.766 ' HD1' ' HA ' ' A' ' 47' ' ' ASP . 76.9 m95 -105.62 145.09 31.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.527 0.68 . . . . 0.0 112.422 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.899 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 4.5 m-70 -136.18 101.66 4.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.819 179.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.765 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.76 165.74 14.15 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.796 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 1.005 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 17.8 mm -133.86 169.66 21.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.22 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.8 HG13 ' N ' ' A' ' 39' ' ' ALA . 5.0 p -166.13 117.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.78 0.324 . . . . 0.0 111.475 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.554 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -151.08 -154.41 6.52 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.06 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.745 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -157.54 32.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.759 0.314 . . . . 0.0 111.388 -179.757 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.745 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER 163.94 29.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.74 179.851 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.82 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.0 OUTLIER -106.6 172.89 6.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.312 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.82 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.2 94.51 0.43 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.945 ' HA ' HD11 ' B' ' 57' ' ' ILE . 69.6 p -82.01 123.61 29.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 111.693 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.832 ' HB2' ' HB3' ' B' ' 39' ' ' ALA . 5.0 t80 -135.11 64.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.16 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.76 ' CB ' ' HB3' ' B' ' 55' ' ' HIS . 26.7 m -101.75 148.11 7.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.145 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.658 ' CB ' HG23 ' B' ' 53' ' ' THR . 5.4 m -91.14 76.05 6.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.509 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 50.8 p-80 -55.1 169.69 0.23 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.463 ' C ' ' OG1' ' A' ' 70' ' ' THR . 0.5 OUTLIER -151.73 169.4 22.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.864 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.517 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER 78.18 -101.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.052 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.665 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 179.03 28.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 1.074 ' HB2' ' HG3' ' A' ' 87' ' ' LYS . 32.6 m-70 -126.95 52.78 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.891 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 2.9 t80 -126.29 114.99 19.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.157 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.904 HG13 ' HB2' ' A' ' 11' ' ' ALA . 1.3 tt -126.4 137.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.895 0.379 . . . . 0.0 111.555 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.572 ' N ' ' O ' ' A' ' 10' ' ' ASN . 38.4 t80 -126.65 116.39 20.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.213 179.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.876 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -139.02 163.29 32.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.004 0.431 . . . . 0.0 111.456 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.624 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 25.8 t80 -121.17 93.41 4.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.499 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.011 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.3 mm? -43.78 172.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.645 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.488 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.82 -39.61 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.584 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.532 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -153.52 21.55 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.956 0.408 . . . . 0.0 110.767 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.848 HG13 ' H ' ' A' ' 82' ' ' ALA . 28.5 t -134.91 177.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.898 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.848 ' H ' HG13 ' A' ' 81' ' ' VAL . . . -137.95 153.33 49.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.805 0.336 . . . . 0.0 110.857 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.734 HG23 ' O ' ' A' ' 57' ' ' ILE . 0.4 OUTLIER -143.49 120.91 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.254 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 1.005 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 13.2 tp -104.6 90.51 3.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.482 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.875 HD13 HG23 ' A' ' 42' ' ' ILE . 0.3 OUTLIER -95.47 141.92 28.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.648 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.891 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 47.0 p90 177.48 138.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.698 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 1.074 ' HG3' ' HB2' ' A' ' 72' ' ' HIS . 8.0 mtmt -97.44 174.11 6.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.66 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.899 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.2 OUTLIER -126.99 16.84 7.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.309 0.576 . . . . 0.0 110.534 179.45 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 CA-C-O 118.364 -1.242 . . . . 0.0 112.558 179.945 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 75.2 mmm . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.784 0.326 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.683 ' O ' HG21 ' B' ' 26' ' ' THR . 0.0 OUTLIER -154.47 -88.49 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.993 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.61 145.53 39.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.834 179.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.644 ' NH1' ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER 62.75 -97.44 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.72 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.593 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 49.61 30.46 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.07 179.93 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.026 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -124.99 -166.89 1.59 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.145 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.688 HG23 ' O ' ' B' ' 6' ' ' ALA . 57.8 t -151.18 73.84 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.957 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.959 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -41.04 159.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.093 0.473 . . . . 0.0 110.826 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.767 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 0.2 OUTLIER -155.04 -10.57 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.511 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.573 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.0 OUTLIER -164.6 84.79 0.42 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.34 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.92 ' HB3' HG13 ' B' ' 74' ' ' ILE . . . -123.53 88.99 3.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.881 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.609 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 10.8 t0 -87.6 25.35 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.26 0.552 . . . . 0.0 109.959 179.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.893 ' HG2' ' N ' ' B' ' 14' ' ' SER . 0.1 OUTLIER -110.96 166.84 10.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.656 -179.723 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.893 ' N ' ' HG2' ' B' ' 13' ' ' MET . 23.2 t -50.07 120.34 4.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.769 0.319 . . . . 0.0 110.731 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.863 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 3.2 mp0 -32.95 -67.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.178 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -46.93 -44.99 20.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.674 179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.877 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 31.7 mmm -61.23 -32.08 71.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.863 ' HG3' ' HA ' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -68.35 -43.16 78.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.878 179.87 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.476 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 2.9 mp0 -69.36 -33.87 73.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -71.4 -33.26 69.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.966 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.802 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.6 OUTLIER -67.94 -40.74 83.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.22 179.435 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.798 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 10.7 t -62.97 -46.12 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.376 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.552 ' HG2' ' H ' ' B' ' 4' ' ' ARG . 29.8 mt-10 -62.58 -32.33 73.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.894 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.428 ' SG ' ' HD1' ' B' ' 46' ' ' PHE . 4.9 t -73.45 -36.44 65.9 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.908 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.904 ' HA ' HG12 ' B' ' 42' ' ' ILE . . . -69.27 -36.54 77.21 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.976 ' HA ' HD13 ' B' ' 29' ' ' LEU . 87.5 m -64.76 -42.79 94.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.618 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.621 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 12.8 mm100 -52.63 -48.67 66.22 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.803 179.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.742 ' HB1' ' HB3' ' B' ' 41' ' ' HIS . . . -59.83 -43.83 94.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.359 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.976 HD13 ' HA ' ' B' ' 26' ' ' THR . 0.9 OUTLIER -59.56 -60.57 3.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.806 179.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -48.57 -33.74 10.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.995 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.621 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 0.0 OUTLIER -85.28 -27.73 25.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.39 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.57 ' HE2' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -155.12 150.82 27.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.831 0.348 . . . . 0.0 111.226 -179.202 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.486 ' O ' HD11 ' B' ' 34' ' ' ILE . 35.6 t30 -115.36 47.07 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.95 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.856 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 42.0 mm -126.08 108.56 19.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.864 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.82 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 26.7 mp0 -29.53 -70.85 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.133 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.421 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -51.23 -49.11 61.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.766 0.317 . . . . 0.0 110.741 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.856 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.8 t0 -53.22 -64.27 0.87 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.862 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.732 ' CG2' ' HB2' ' B' ' 28' ' ' ALA . 11.6 mt -48.9 -43.74 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.691 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.832 ' HB3' ' HB2' ' A' ' 65' ' ' TYR . . . -55.32 -46.71 76.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.468 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.784 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -61.42 -67.27 0.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.496 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.742 ' HB3' ' HB1' ' B' ' 28' ' ' ALA . 0.7 OUTLIER -34.15 -40.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.538 179.44 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 1.058 HG21 HD11 ' B' ' 85' ' ' LEU . 33.9 mt -67.33 -50.91 58.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.298 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.699 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 6.1 tttt -55.33 -46.88 76.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.174 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -67.24 -36.83 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.209 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.609 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 8.5 mm-40 -68.45 -44.8 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.905 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.802 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -67.37 -35.27 79.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.678 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.866 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -66.79 -38.77 87.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.221 179.763 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.982 ' HA ' ' HE3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.66 -18.21 25.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.111 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.609 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.75 -29.58 19.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.383 -179.573 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.625 ' HE2' ' CD1' ' B' ' 46' ' ' PHE . 7.0 m-85 -131.74 -57.16 0.99 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.533 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.588 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 27.4 t-20 157.23 119.36 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.11 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.418 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.866 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 20.3 Cg_endo -59.77 170.72 3.31 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.558 2.172 . . . . 0.0 112.255 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.732 ' O ' ' HB3' ' B' ' 87' ' ' LYS . 4.4 m -106.85 129.47 54.69 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 123.154 0.582 . . . . 0.0 110.475 0.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.699 ' O ' ' HG3' ' B' ' 43' ' ' LYS . 58.0 m95 -101.74 116.81 33.54 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.835 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.0 OUTLIER -93.69 100.14 12.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.286 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.689 ' HB2' ' CD1' ' B' ' 85' ' ' LEU . 0.0 OUTLIER -108.54 148.62 30.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.305 0.574 . . . . 0.0 112.457 -178.005 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.945 HD11 ' HA ' ' A' ' 64' ' ' SER . 19.5 mm -133.6 103.7 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.376 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.813 HG11 ' HB1' ' B' ' 39' ' ' ALA . 2.4 p -105.87 117.78 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.398 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.765 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -132.43 -104.88 0.94 Allowed Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.177 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.563 ' HD3' ' CG ' ' A' ' 61' ' ' ASN . 1.0 OUTLIER 179.67 -17.71 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.777 0.323 . . . . 0.0 111.131 -179.778 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.469 ' CG ' ' O ' ' B' ' 60' ' ' ARG . 1.2 m120 177.78 41.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.82 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 27.6 p90 -87.61 -167.71 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -131.41 86.6 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.19 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.817 ' HB3' ' HE2' ' B' ' 62' ' ' PHE . 5.5 p -83.3 119.01 24.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 0.0 111.315 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.801 ' CE1' ' HB2' ' A' ' 40' ' ' ALA . 22.9 t80 -127.28 73.35 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.367 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.782 HG21 ' CE1' ' B' ' 86' ' ' PHE . 21.1 m -125.15 156.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.404 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.774 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 20.7 m -84.99 145.99 27.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.756 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.714 ' H ' ' ND1' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -97.5 173.44 7.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.925 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.707 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 1.3 mm-40 -138.59 -114.92 0.15 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.12 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.62 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -47.29 -103.45 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.066 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.657 ' O ' ' HB2' ' B' ' 72' ' ' HIS . 1.3 mmtt -55.45 0.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.771 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 0.7 OUTLIER 76.77 -89.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.622 -179.859 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.771 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 3.8 p90 163.46 155.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.986 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.92 HG13 ' HB3' ' B' ' 11' ' ' ALA . 1.1 tt -129.6 130.65 67.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.204 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.679 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -113.57 132.32 55.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.056 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.959 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.4 OUTLIER -158.21 152.54 24.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.966 0.412 . . . . 0.0 111.373 -179.45 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.562 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 1.0 OUTLIER -119.74 112.02 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.759 179.7 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.026 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -71.11 170.61 12.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.598 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.507 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.19 -55.93 0.06 OUTLIER Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.94 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.721 ' O ' HG22 ' B' ' 81' ' ' VAL . 0.2 OUTLIER -139.54 35.89 2.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.797 0.332 . . . . 0.0 111.035 179.998 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.835 HG13 ' N ' ' B' ' 82' ' ' ALA . 92.2 t -151.05 170.19 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.835 ' N ' HG13 ' B' ' 81' ' ' VAL . . . -130.18 157.73 41.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.652 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.742 HD11 HG21 ' B' ' 58' ' ' VAL . 0.1 OUTLIER -146.18 133.3 14.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.906 0.384 . . . . 0.0 111.537 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.679 ' HB2' ' CE1' ' B' ' 75' ' ' TYR . 0.5 OUTLIER -126.87 90.59 3.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.004 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 1.058 HD11 HG21 ' B' ' 42' ' ' ILE . 0.3 OUTLIER -90.74 130.74 36.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -178.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.782 ' CE1' HG21 ' B' ' 66' ' ' VAL . 1.6 p90 -169.15 120.97 0.75 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.833 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.732 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -87.67 162.99 16.79 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.909 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.835 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 3.0 m -115.87 19.25 15.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.184 0.516 . . . . 0.0 110.89 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.425 -1.208 . . . . 0.0 112.581 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.522 ' HA ' HH12 ' A' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.851 0.357 . . . . 0.0 111.204 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 172.98 -35.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.758 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -130.51 -1.53 4.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.603 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.779 ' HB2' HH11 ' A' ' 4' ' ' ARG . 0.0 OUTLIER -63.09 -47.3 83.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.953 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.8 tttp 43.89 -162.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.121 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.066 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 59.41 175.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.34 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.737 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 3.8 t -144.59 73.05 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.546 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.999 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -43.24 130.2 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.883 0.373 . . . . 0.0 110.104 179.578 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.744 ' HE3' ' HB3' ' A' ' 77' ' ' TYR . 2.4 mmtp -120.91 -12.56 8.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.631 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.608 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 2.6 t30 -149.78 -92.1 0.07 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.383 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.882 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 67.21 -163.79 0.22 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.772 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.606 ' N ' ' O ' ' A' ' 73' ' ' PHE . 3.5 t0 169.34 31.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.967 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.892 ' SD ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -106.07 160.34 15.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.146 -179.439 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.573 ' O ' ' N ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -65.78 72.26 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.686 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 3.4 mt-10 32.92 -88.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.213 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 14' ' ' SER . 6.3 pt-20 -31.36 -32.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.108 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.722 ' HG3' ' CB ' ' A' ' 13' ' ' MET . 6.4 tpp -75.02 -45.53 41.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.054 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.686 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -63.22 -29.28 70.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 0.0 110.831 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.623 ' OE1' ' HG3' ' A' ' 4' ' ' ARG . 74.1 mm-40 -76.92 -45.07 29.22 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.752 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -68.68 -30.9 69.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.803 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.804 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.9 OUTLIER -64.55 -48.16 76.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.678 178.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.829 HG13 ' HB2' ' A' ' 6' ' ' ALA . 55.7 t -55.56 -50.48 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.183 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -52.88 -37.96 61.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.382 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.65 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 76.5 m -68.93 -36.85 78.46 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.147 0.499 . . . . 0.0 110.185 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 1.017 ' HA ' HD11 ' A' ' 42' ' ' ILE . . . -69.66 -30.06 67.65 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 1.054 ' HA ' HD12 ' A' ' 29' ' ' LEU . 94.8 m -74.08 -43.29 58.22 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.103 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.831 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -52.66 -44.16 66.0 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.075 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.831 ' N ' ' HG3' ' A' ' 27' ' ' GLN . . . -75.47 -26.58 58.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.205 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 1.054 HD12 ' HA ' ' A' ' 26' ' ' THR . 3.6 mt -67.72 -44.93 76.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.374 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -81.0 -28.98 35.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.053 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.54 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.6 OUTLIER -77.43 -31.04 53.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.972 0.415 . . . . 0.0 110.92 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.641 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -160.82 138.86 9.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.511 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -100.97 27.84 5.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 0.0 110.627 179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.744 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 50.4 mm -99.63 91.62 2.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.966 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.713 ' HB3' ' CA ' ' B' ' 63' ' ' GLY . 4.1 mp0 -23.25 -78.93 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.144 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.666 ' HD2' ' CG2' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.42 -42.3 3.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.899 179.725 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.744 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.3 t0 -63.61 -60.73 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.993 0.425 . . . . 0.0 110.583 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.849 HG21 HD13 ' A' ' 42' ' ' ILE . 41.0 mt -47.97 -40.23 8.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.409 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.922 ' HB1' HG13 ' A' ' 58' ' ' VAL . . . -69.31 -41.78 76.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.39 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.746 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -54.39 -57.46 11.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.225 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.575 ' NE2' ' O ' ' A' ' 37' ' ' ASP . 0.0 OUTLIER -59.17 -57.32 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.98 -179.874 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 1.017 HD11 ' HA ' ' A' ' 25' ' ' ALA . 91.8 mt -38.67 -45.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.337 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.739 ' HD3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -68.3 -59.61 3.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.019 -179.77 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.445 ' O ' ' OD2' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -43.76 -51.23 7.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.294 -179.656 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 5.0 tt0 -65.74 -49.31 68.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.991 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.804 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -58.21 -27.98 64.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.767 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -81.01 -34.11 33.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 5.95 47.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.125 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -126.44 -5.69 6.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.871 179.922 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.752 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 53.8 m-85 -136.82 -63.93 0.6 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.065 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.672 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 7.1 t-20 160.82 110.59 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.38 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.767 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 35.1 Cg_exo -58.38 157.69 25.55 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.433 2.088 . . . . 0.0 112.478 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.765 HG23 ' NE2' ' A' ' 55' ' ' HIS . 11.1 t -108.84 139.0 44.27 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.932 0.493 . . . . 0.0 110.49 -0.101 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.823 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 62.2 m95 -101.9 121.14 41.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.2 0.524 . . . . 0.0 112.193 -178.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.875 ' NE2' HG21 ' B' ' 67' ' ' THR . 0.1 OUTLIER -103.36 93.71 5.11 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.436 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.678 ' HB3' ' HG ' ' A' ' 85' ' ' LEU . 1.6 p -112.78 161.7 16.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.323 0.583 . . . . 0.0 112.489 -178.008 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.974 HD11 ' HA ' ' B' ' 64' ' ' SER . 21.9 mm -134.15 159.01 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.036 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.922 HG13 ' HB1' ' A' ' 39' ' ' ALA . 4.3 p -157.59 107.7 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.881 0.372 . . . . 0.0 111.531 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.752 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -143.58 -153.67 5.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.207 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.703 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.68 28.5 0.1 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.628 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.703 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 30.5 t30 167.94 27.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.458 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.988 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -98.54 -157.24 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.978 179.721 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.584 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -154.85 81.17 0.17 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.118 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.793 ' HA ' HG12 ' B' ' 57' ' ' ILE . 74.0 p -66.69 161.2 23.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.012 0.435 . . . . 0.0 111.326 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.759 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 63.3 t80 -167.8 45.32 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.484 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.8 HG11 ' HB3' ' B' ' 55' ' ' HIS . 3.5 m -97.56 152.44 4.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.872 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.908 HG21 HG23 ' B' ' 53' ' ' THR . 1.0 OUTLIER -96.96 147.96 23.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.995 -179.778 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.498 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -97.74 169.81 9.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.687 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.529 ' O ' HG22 ' A' ' 70' ' ' THR . 2.6 pt-20 -170.31 69.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.106 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.529 HG22 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 167.24 -110.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.231 179.822 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.703 ' O ' ' HA ' ' A' ' 13' ' ' MET . 20.5 pttm -162.19 6.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.662 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.84 ' HB2' ' HD3' ' A' ' 87' ' ' LYS . 2.1 m-70 -117.35 61.88 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.949 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.709 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.3 t80 -133.69 94.77 3.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.746 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.892 ' HB ' ' SD ' ' A' ' 13' ' ' MET . 2.4 tt -110.18 134.82 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.304 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.62 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 3.4 t80 -127.15 88.86 2.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.231 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.999 ' HB3' HG13 ' A' ' 8' ' ' ILE . 3.1 p90 -114.86 174.35 6.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.36 -179.309 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.744 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 24.2 t80 -130.61 105.23 7.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.749 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.066 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.3 mm? -55.05 163.99 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.912 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.478 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.27 -47.38 0.18 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.54 20.09 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.709 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.752 HG13 ' O ' ' A' ' 59' ' ' GLY . 28.3 t -139.19 177.4 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.705 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.772 ' O ' ' HA ' ' A' ' 58' ' ' VAL . . . -138.24 151.15 47.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.55 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.702 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -141.89 122.04 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.957 0.408 . . . . 0.0 111.039 -179.696 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.935 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 4.7 tp -109.82 85.05 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.678 ' HG ' ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -87.84 137.91 31.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.766 ' HA ' ' O ' ' A' ' 72' ' ' HIS . 1.6 p90 -179.26 132.01 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.373 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.84 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 1.2 mtpm? -102.49 -157.68 0.62 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.782 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -156.47 20.53 0.35 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.319 0.58 . . . . 0.0 110.569 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.336 -1.258 . . . . 0.0 112.453 -179.962 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.7 mtt . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.822 0.344 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.411 ' O ' ' SG ' ' B' ' 2' ' ' CYS . 1.2 p -103.21 128.66 50.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.026 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -141.79 -166.02 2.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.877 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.511 ' H ' ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -101.54 -54.67 2.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.84 179.986 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.595 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.0 OUTLIER 49.12 29.45 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.917 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.062 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -123.78 -168.3 1.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.302 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.639 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 40.2 t -153.46 76.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.209 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.761 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.4 mp -35.04 146.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.538 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.881 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 8.8 mmpt? -121.74 -23.39 5.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.376 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.492 HD21 ' HZ ' ' B' ' 73' ' ' PHE . 5.2 t30 -153.11 -86.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.334 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.805 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 59.05 120.49 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.672 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.656 ' HB2' ' CE1' ' B' ' 73' ' ' PHE . 0.5 OUTLIER -117.75 25.12 10.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.261 0.553 . . . . 0.0 110.263 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.727 ' HG3' ' H ' ' B' ' 14' ' ' SER . 14.0 ttp -108.45 169.78 8.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.756 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.727 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.8 OUTLIER -52.51 132.88 35.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.798 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -42.73 -65.96 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.902 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -43.86 -34.12 1.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.804 ' SD ' ' HD3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -73.49 -32.72 64.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.892 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.9 OUTLIER -68.48 -37.58 80.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.89 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.647 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -73.62 -38.35 65.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.35 -35.07 71.04 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.657 -0.702 . . . . 0.0 109.759 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.809 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -63.66 -40.82 97.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.844 179.131 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.797 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 27.5 t -63.57 -44.6 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.304 179.312 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.647 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 51.5 mt-10 -57.59 -38.73 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.424 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.891 ' HB3' HG21 ' B' ' 42' ' ' ILE . 0.0 OUTLIER -67.82 -36.62 80.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.318 179.53 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.671 ' HA ' HG12 ' B' ' 42' ' ' ILE . . . -71.7 -30.08 65.28 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.836 ' HA ' HD11 ' B' ' 29' ' ' LEU . 11.4 m -73.29 -39.24 65.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.619 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.826 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -57.74 -43.7 85.56 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.404 178.826 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 1.005 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -68.8 -37.86 79.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.181 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.836 HD11 ' HA ' ' B' ' 26' ' ' THR . 1.4 mt -63.33 -39.5 94.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.779 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.16 -23.36 38.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.919 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.735 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -86.8 -25.36 24.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.811 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.601 ' HE2' ' HB2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -157.63 175.1 14.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.59 ' OD1' HD12 ' B' ' 34' ' ' ILE . 25.0 p30 -133.62 38.4 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.081 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.886 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 5.0 mm -121.4 106.16 17.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.67 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.681 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 3.2 mp0 -29.52 -70.5 0.05 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.937 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.421 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.87 -37.84 14.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.622 179.603 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.886 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 20.0 t0 -66.92 -60.26 2.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 1.005 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 4.3 mt -47.71 -47.34 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.769 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.847 ' N ' HG13 ' B' ' 58' ' ' VAL . . . -55.66 -50.37 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.636 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.759 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -56.44 -62.1 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.56 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.826 ' NE2' ' HB3' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -36.18 -55.02 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.234 179.436 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.891 HG21 ' HB3' ' B' ' 24' ' ' CYS . 16.3 mt -51.39 -69.98 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.089 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.827 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.0 OUTLIER -34.94 -63.34 0.32 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.414 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 0.3 OUTLIER -46.21 -41.63 13.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.114 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.776 ' HB3' ' SG ' ' B' ' 24' ' ' CYS . 2.0 tp10 -69.36 -44.16 72.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.89 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.809 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -65.9 -29.86 70.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.929 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.937 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.63 -40.56 66.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.693 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.503 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.12 -17.97 26.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.052 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.723 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.6 OUTLIER -88.34 -36.42 16.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.763 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.703 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 2.1 m-85 -123.46 -57.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.101 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.703 ' HB3' ' O ' ' B' ' 50' ' ' TYR . 5.9 p-10 154.3 119.62 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.105 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.747 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.937 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 19.2 Cg_endo -59.09 168.49 4.56 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.254 1.969 . . . . 0.0 112.556 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.908 HG23 HG21 ' A' ' 67' ' ' THR . 1.2 t -112.7 119.16 37.13 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 122.726 0.41 . . . . 0.0 111.001 0.035 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.797 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 26.6 m95 -91.2 113.74 26.08 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.38 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.8 ' HB3' HG11 ' A' ' 66' ' ' VAL . 3.2 m-70 -72.55 116.13 12.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.827 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 3.6 m -114.95 135.8 53.82 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.278 0.561 . . . . 0.0 112.438 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.793 HG12 ' HA ' ' A' ' 64' ' ' SER . 13.7 mt -139.98 104.92 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.02 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.847 HG13 ' N ' ' B' ' 39' ' ' ALA . 2.8 p -112.52 125.81 69.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.684 -179.064 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.748 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -146.14 -131.33 2.25 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.682 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -165.69 -0.34 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 120.774 0.321 . . . . 0.0 111.091 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -173.96 34.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.988 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.8 p90 -93.67 163.42 13.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.675 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.713 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -118.15 80.27 0.31 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.815 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.974 ' HA ' HD11 ' A' ' 57' ' ' ILE . 16.0 p -77.9 128.02 33.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 111.368 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.746 ' CD1' ' HA ' ' A' ' 40' ' ' ALA . 25.2 t80 -136.85 68.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.348 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.822 HG11 HD13 ' A' ' 57' ' ' ILE . 29.8 m -111.58 151.81 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.107 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.875 HG21 ' NE2' ' A' ' 55' ' ' HIS . 3.7 t -80.97 120.12 24.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.885 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.695 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -60.0 157.27 13.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.566 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 2.3 mt-10 -148.77 151.85 35.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.97 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.54 ' CG2' ' N ' ' B' ' 71' ' ' LYS . 42.2 m 57.63 -107.64 0.38 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.556 -179.676 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.804 ' HD3' ' SD ' ' B' ' 17' ' ' MET . 26.7 mttp -72.2 8.29 1.37 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.433 . . . . 0.0 110.375 179.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.762 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 24.8 m-70 79.6 -86.78 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.431 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.762 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 160.91 -175.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.745 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.892 HG13 ' HB3' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -158.13 117.58 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.099 179.626 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.809 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 13.2 t80 -108.15 139.21 43.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.605 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.797 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 1.3 p90 -160.32 169.98 22.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.608 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.618 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 23.5 t80 -132.02 113.83 13.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.062 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.4 mm? -70.93 169.43 14.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.781 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.51 -51.82 0.05 OUTLIER Glycine 0 C--N 1.333 0.372 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.845 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.693 ' O ' HG22 ' B' ' 81' ' ' VAL . 3.0 tt0 -143.25 41.61 1.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.81 0.338 . . . . 0.0 110.405 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.809 HG13 ' H ' ' B' ' 82' ' ' ALA . 60.4 t -157.9 169.9 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.189 -179.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.809 ' H ' HG13 ' B' ' 81' ' ' VAL . . . -135.12 141.74 46.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.329 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.739 ' CG1' HD22 ' B' ' 78' ' ' LEU . 0.2 OUTLIER -128.79 130.53 68.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.085 0.469 . . . . 0.0 111.939 -179.416 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.686 HD22 ' HB ' ' B' ' 57' ' ' ILE . 0.4 OUTLIER -117.33 97.88 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.641 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 1.2 mp -101.09 112.43 24.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.403 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.75 ' CE1' HG23 ' B' ' 66' ' ' VAL . 6.7 p90 -149.71 128.8 12.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.752 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.797 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 42.4 mtpt -93.4 170.12 9.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.296 -179.581 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.76 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -119.2 19.27 12.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.638 179.728 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . 0.538 ' HA2' ' HG1' ' B' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.459 -1.189 . . . . 0.0 112.544 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.815 0.341 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.526 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 36.1 m -63.07 -14.69 51.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.03 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.775 ' HB3' ' NH2' ' A' ' 4' ' ' ARG . 14.3 m-20 71.37 98.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.881 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.775 ' NH2' ' HB3' ' A' ' 3' ' ' ASP . 0.0 OUTLIER 80.67 88.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.7 ' O ' HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -54.53 -170.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.859 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.093 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 81.47 152.29 0.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.437 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.565 ' O ' HG13 ' A' ' 7' ' ' VAL . 55.5 t -113.89 74.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.809 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.873 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -39.01 158.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.676 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -151.69 -8.92 0.22 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.764 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.538 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -172.95 92.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.41 180.0 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.821 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -128.76 77.04 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.786 -179.509 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.573 ' O ' ' HB2' ' A' ' 72' ' ' HIS . 0.2 OUTLIER -73.72 26.94 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.064 179.104 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.853 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -111.84 171.24 7.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.564 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.853 ' N ' ' HG2' ' A' ' 13' ' ' MET . 18.9 m -56.47 151.56 13.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.767 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.664 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -56.26 -65.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.956 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.726 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -51.39 -25.23 5.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.759 ' HE1' ' CD2' ' A' ' 50' ' ' TYR . 68.1 mmm -78.77 -36.23 43.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.061 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.735 ' CA ' HD13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -73.34 -36.81 66.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.735 ' CB ' ' HG2' ' A' ' 4' ' ' ARG . 37.0 mt-30 -74.74 -36.33 62.64 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.726 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -73.02 -31.72 64.65 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.678 178.918 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.779 ' OG ' HG21 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -64.77 -46.18 83.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.835 179.142 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.824 HG11 ' HB3' ' A' ' 6' ' ' ALA . 97.2 t -60.06 -50.66 79.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.405 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.68 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 6.5 mt-10 -52.97 -37.94 61.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.364 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.404 ' SG ' ' CE1' ' A' ' 46' ' ' PHE . 56.9 m -65.19 -40.27 93.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.135 0.493 . . . . 0.0 110.056 179.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.938 ' HB1' HG22 ' A' ' 83' ' ' ILE . . . -68.42 -33.39 74.14 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.712 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -71.51 -35.97 70.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.748 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.576 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 1.6 mt-30 -57.4 -42.96 83.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.373 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 1.048 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -85.93 -24.16 26.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.862 HD23 HG11 ' A' ' 81' ' ' VAL . 4.7 mt -75.51 -26.35 58.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.728 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.47 -35.27 11.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.607 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.576 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -83.96 -8.59 59.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.321 179.541 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.634 ' CD2' ' HE1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -154.17 -174.57 5.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.791 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -154.57 26.2 0.45 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.569 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 1.047 ' HB ' ' HB3' ' A' ' 37' ' ' ASP . 11.5 mm -116.01 102.24 13.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.836 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.836 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 4.5 mp0 -25.28 -78.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.183 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.775 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -41.56 -46.24 3.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.703 179.63 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 1.047 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -58.03 -60.04 4.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.779 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 1.048 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 2.1 mt -48.61 -46.92 15.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.839 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.811 ' HB2' ' HB3' ' B' ' 65' ' ' TYR . . . -59.92 -53.14 61.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.04 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.688 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -42.16 -56.65 2.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.634 ' HE1' ' CD2' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -59.69 -57.04 14.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.907 -179.974 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.866 HG22 HD13 ' A' ' 85' ' ' LEU . 56.5 mt -42.9 -68.13 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.14 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.734 ' HB3' ' CD2' ' B' ' 65' ' ' TYR . 1.5 tmtt? -50.9 -34.85 30.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.94 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.641 ' HZ1' ' HH ' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -61.03 -68.94 0.26 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.861 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.593 ' O ' ' N ' ' A' ' 49' ' ' LYS . 39.8 mt-10 -48.23 -54.05 14.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.776 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.8 OUTLIER -45.9 -51.66 12.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.796 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.784 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -64.23 -23.35 67.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.172 -179.837 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.58 11.43 18.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.242 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.593 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -130.4 -8.62 4.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.743 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.759 ' CD2' ' HE1' ' A' ' 17' ' ' MET . 84.0 m-85 -136.58 -63.5 0.62 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.85 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.558 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 0.5 OUTLIER 157.25 117.98 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.258 -179.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.784 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 20.6 Cg_endo -60.86 167.08 9.23 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.422 2.081 . . . . 0.0 112.42 -179.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.75 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.0 OUTLIER -108.86 122.18 46.66 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.039 0.536 . . . . 0.0 110.803 0.046 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.807 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 36.5 m95 -93.48 149.92 20.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 112.034 -179.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.899 ' HB3' HG12 ' B' ' 66' ' ' VAL . 5.4 m-70 -127.37 103.49 7.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.418 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.82 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.6 OUTLIER -112.45 132.41 55.07 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.503 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.946 HG21 HG23 ' B' ' 57' ' ' ILE . 29.1 mm -120.24 107.17 20.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.167 178.755 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.823 HG11 ' HB ' ' A' ' 38' ' ' ILE . 4.8 p -107.5 131.21 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.966 0.412 . . . . 0.0 111.609 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.753 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -154.9 -142.79 3.52 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.817 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.436 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -160.21 3.58 0.08 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.743 0.272 . . . . 0.0 111.679 -179.856 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -177.4 31.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.422 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 1.068 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -92.37 -160.28 0.73 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.964 0.412 . . . . 0.0 110.983 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.719 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -152.72 78.59 0.2 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.034 -0.603 . . . . 0.0 111.941 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.927 ' HA ' HD13 ' B' ' 57' ' ' ILE . 25.6 p -72.9 140.27 47.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.972 0.415 . . . . 0.0 111.142 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.81 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 61.2 t80 -152.68 84.17 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.513 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.923 HG12 ' HB3' ' B' ' 55' ' ' HIS . 3.2 m -132.21 168.08 24.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.282 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.531 HG22 ' CG2' ' B' ' 53' ' ' THR . 1.3 t -83.78 -178.48 7.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.616 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.724 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -130.13 153.03 48.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.705 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.929 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 5.3 mm-40 -127.05 -124.61 0.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.272 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.563 ' HG1' ' H ' ' A' ' 71' ' ' LYS . 11.2 p -31.11 -99.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.779 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.691 ' O ' ' HB2' ' A' ' 13' ' ' MET . 3.0 mmtp -73.18 27.61 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.093 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.757 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 21.1 m-70 62.05 -90.63 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.757 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER 161.66 158.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.503 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.821 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 0.7 OUTLIER -127.77 134.7 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.023 0.44 . . . . 0.0 111.301 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.781 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 1.4 t80 -124.79 138.84 54.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.161 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.873 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.6 OUTLIER -163.65 164.45 23.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.876 0.37 . . . . 0.0 111.032 -179.692 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.788 ' HD1' ' HB1' ' A' ' 82' ' ' ALA . 74.6 t80 -127.49 94.52 4.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.081 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.093 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.6 mm? -44.05 158.21 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.855 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.455 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.92 -28.91 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.639 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.76 ' O ' HG23 ' A' ' 81' ' ' VAL . 13.5 pt20 -153.13 33.41 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.918 0.39 . . . . 0.0 110.946 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.871 HG13 ' N ' ' A' ' 82' ' ' ALA . 72.6 t -156.48 170.89 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.871 ' N ' HG13 ' A' ' 81' ' ' VAL . . . -136.56 119.05 15.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.858 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.938 HG22 ' HB1' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -111.6 129.33 67.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.003 0.43 . . . . 0.0 111.612 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.806 HD23 HG12 ' A' ' 57' ' ' ILE . 0.6 OUTLIER -116.22 92.0 3.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.279 179.647 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.866 HD13 HG22 ' A' ' 42' ' ' ILE . 3.1 mp -92.85 135.15 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.003 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.752 ' CE1' HG22 ' A' ' 66' ' ' VAL . 1.4 p90 -171.65 121.14 0.49 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.058 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.807 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 1.8 ptmt -104.53 143.16 33.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.785 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.929 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -105.44 16.77 25.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 110.814 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.442 -1.199 . . . . 0.0 112.31 179.845 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.884 0.374 . . . . 0.0 111.243 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.404 ' O ' ' HB3' ' B' ' 3' ' ' ASP . 62.9 m -103.29 -62.7 1.25 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.714 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.464 ' C ' ' OD1' ' B' ' 3' ' ' ASP . 28.4 p30 179.05 178.52 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.778 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.743 ' O ' ' HG3' ' B' ' 4' ' ' ARG . 7.8 tpt180 60.89 6.71 1.26 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.004 0.431 . . . . 0.0 110.568 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.503 ' O ' HD12 ' B' ' 78' ' ' LEU . 13.3 tttt -30.62 111.62 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.935 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.017 ' HB1' HG13 ' B' ' 22' ' ' VAL . . . 160.74 -172.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.853 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.773 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 53.0 t -150.36 71.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.813 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.98 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.84 143.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.973 -179.803 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.773 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 8.8 mmpt? -112.17 -28.41 7.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.923 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.736 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -157.5 -91.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.241 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.858 ' HB2' ' NE2' ' B' ' 18' ' ' GLN . . . 78.44 97.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.066 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.2 t0 -90.47 29.84 1.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.18 0.514 . . . . 0.0 109.975 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.996 ' HE3' HG22 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -116.25 153.26 32.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.606 -179.66 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.758 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -37.0 154.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.546 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -61.79 -68.22 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.794 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -48.3 -24.06 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.666 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.901 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -76.88 -42.56 39.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.851 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 1.087 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -65.32 -29.15 69.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.035 0.445 . . . . 0.0 110.252 179.525 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.501 ' NE2' ' HD3' ' B' ' 4' ' ' ARG . 4.3 mm100 -77.59 -43.26 32.23 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.28 0.562 . . . . 0.0 109.598 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.833 ' HB3' ' HH ' ' B' ' 50' ' ' TYR . 0.9 OUTLIER -69.78 -27.69 65.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.682 178.895 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.791 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 2.5 t -68.04 -49.56 60.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.928 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 1.017 HG13 ' HB1' ' B' ' 6' ' ' ALA . 76.7 t -55.77 -46.54 79.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.156 179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.53 -40.26 86.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.023 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.619 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 1.3 m -66.68 -34.28 77.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.759 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.648 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -71.45 -32.26 68.11 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.877 ' HA ' HD11 ' B' ' 29' ' ' LEU . 12.4 m -70.94 -41.25 71.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.142 -1.39 . . . . 0.0 109.858 178.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.777 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 3.3 mm100 -55.83 -46.9 78.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.752 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.896 ' HB2' ' HB3' ' B' ' 41' ' ' HIS . . . -65.58 -34.39 78.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.403 179.239 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.877 HD11 ' HA ' ' B' ' 26' ' ' THR . 1.4 mt -66.21 -50.18 64.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.16 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -66.7 -27.59 67.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.013 -179.811 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.777 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 28.0 mmtp -85.68 -26.81 25.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.89 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.63 ' HH ' ' HD1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -157.33 151.78 25.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.729 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.532 ' C ' HD12 ' B' ' 34' ' ' ILE . 1.5 p30 -113.28 36.37 3.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.903 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.789 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.6 mm -118.98 108.72 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.719 ' HB3' ' HA3' ' A' ' 63' ' ' GLY . 54.7 mm-40 -29.7 -71.08 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.024 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.444 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.1 OUTLIER -46.32 -45.99 17.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.895 0.379 . . . . 0.0 110.646 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.789 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 15.0 t0 -58.92 -61.28 2.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.85 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.835 ' HA ' ' HB3' ' B' ' 28' ' ' ALA . 2.1 mt -43.93 -47.75 2.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.816 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 1.011 ' HB1' HG12 ' B' ' 58' ' ' VAL . . . -57.14 -59.43 5.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.529 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -45.63 -61.57 1.65 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.896 ' HB3' ' HB2' ' B' ' 28' ' ' ALA . 0.9 OUTLIER -41.62 -49.04 4.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.264 179.387 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.648 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 18.8 mt -61.51 -68.64 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.793 ' HE2' ' HB3' ' B' ' 47' ' ' ASP . 1.4 tptm -39.62 -27.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.68 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -75.98 -60.34 2.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.0 0.429 . . . . 0.0 110.858 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.71 ' HG2' ' O ' ' B' ' 41' ' ' HIS . 0.4 OUTLIER -60.56 -25.88 66.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.04 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.791 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -76.86 -48.04 19.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.419 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.793 ' HB3' ' HE2' ' B' ' 43' ' ' LYS . 3.2 p30 -64.21 -27.17 68.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.274 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.431 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -90.03 -41.61 11.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.029 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.659 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -79.04 -20.02 49.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.048 -179.632 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.833 ' HH ' ' HB3' ' B' ' 20' ' ' ASP . 8.9 m-85 -128.66 -70.03 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.452 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.795 HD21 ' HD2' ' B' ' 52' ' ' PRO . 1.3 t-20 157.38 117.58 0.0 OUTLIER Pre-proline 0 CA--C 1.529 0.163 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.479 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.795 ' HD2' HD21 ' B' ' 51' ' ' ASN . 30.1 Cg_endo -63.01 170.1 8.03 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.369 2.046 . . . . 0.0 112.526 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.621 ' HA ' ' HE3' ' B' ' 43' ' ' LYS . 0.6 OUTLIER -103.54 132.49 49.74 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 122.822 0.449 . . . . 0.0 110.544 0.041 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.779 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 46.4 m95 -101.62 104.66 15.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.574 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.923 ' HB3' HG12 ' A' ' 66' ' ' VAL . 37.1 m-70 -69.42 90.71 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.77 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 23.8 p -105.06 123.73 48.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.059 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.946 HG23 HG21 ' A' ' 57' ' ' ILE . 19.0 mm -118.08 108.28 24.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.088 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 1.011 HG12 ' HB1' ' B' ' 39' ' ' ALA . 2.4 p -111.07 120.91 62.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.868 0.366 . . . . 0.0 111.369 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.633 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.77 -136.09 3.47 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.063 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.477 ' O ' ' OD1' ' B' ' 61' ' ' ASN . 0.4 OUTLIER -162.67 5.61 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 120.873 0.368 . . . . 0.0 111.13 -179.568 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.477 ' OD1' ' O ' ' B' ' 60' ' ' ARG . 0.8 OUTLIER 171.18 31.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 1.068 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -89.29 -170.4 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.024 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.836 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -139.46 76.92 0.33 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.081 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.919 ' HA ' HD12 ' A' ' 57' ' ' ILE . 9.6 p -69.66 138.12 52.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.012 0.434 . . . . 0.0 111.191 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.811 ' HB3' ' HB2' ' A' ' 39' ' ' ALA . 68.3 t80 -146.24 88.55 1.8 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.899 HG12 ' HB3' ' A' ' 55' ' ' HIS . 10.2 m -125.74 145.68 32.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.348 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.75 HG21 ' CG2' ' A' ' 53' ' ' THR . 0.0 OUTLIER -80.13 70.05 6.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.632 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.538 ' CD2' ' CD2' ' B' ' 73' ' ' PHE . 1.6 p-80 -51.24 160.91 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' B' ' 71' ' ' LYS . 0.8 OUTLIER -156.84 -144.75 0.14 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.768 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.681 ' HG1' ' N ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 39.99 -90.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.717 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.5 OUTLIER 163.21 21.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 179.938 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.492 ' HB3' ' CZ3' ' B' ' 54' ' ' TRP . 39.6 m80 -115.96 52.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.765 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.858 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.9 t80 -127.34 123.92 37.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 1.087 HG13 ' HB3' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -135.42 117.36 20.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.537 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.568 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -103.35 134.74 46.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.007 178.972 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.98 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.5 OUTLIER -162.68 169.15 20.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.902 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.692 ' HH ' ' HA ' ' B' ' 80' ' ' GLN . 49.4 t80 -135.38 115.77 13.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.756 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 0.967 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -68.77 169.99 10.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.763 -179.769 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.427 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -35.09 -35.46 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.742 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.692 ' HA ' ' HH ' ' B' ' 77' ' ' TYR . 1.4 pt20 -154.38 33.8 0.42 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.823 0.344 . . . . 0.0 111.134 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.592 ' O ' ' N ' ' B' ' 78' ' ' LEU . 55.3 t -152.83 168.22 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.613 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.702 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -131.62 152.29 50.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.819 0.343 . . . . 0.0 111.111 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.552 HG13 ' CE2' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -141.95 123.77 13.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.393 -179.628 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.838 HD21 ' HB2' ' B' ' 64' ' ' SER . 0.4 OUTLIER -117.89 90.2 3.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.404 179.756 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.762 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -94.64 130.78 40.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.618 -179.442 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.858 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 16.8 p90 -169.01 132.53 1.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.476 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.779 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 1.2 mtpp -108.16 170.47 7.98 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.733 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.7 ' HB2' ' HE2' ' B' ' 55' ' ' HIS . 0.2 OUTLIER -122.01 19.89 10.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.306 0.574 . . . . 0.0 110.998 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.426 -1.208 . . . . 0.0 112.598 -179.919 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtp . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.817 0.341 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.12 85.33 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.951 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.753 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 1.3 m-20 -117.8 -133.25 0.32 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.083 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.852 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -122.95 70.16 1.01 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.141 -179.823 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.724 ' O ' HD12 ' A' ' 78' ' ' LEU . 22.3 tptm -85.17 44.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.791 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.016 ' HB2' HD11 ' A' ' 78' ' ' LEU . . . -128.28 173.7 9.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.406 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.793 HG13 ' HE2' ' A' ' 9' ' ' LYS . 38.5 t -132.7 81.32 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.674 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.904 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -50.32 150.62 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.978 0.418 . . . . 0.0 110.505 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.793 ' HE2' HG13 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -159.42 1.11 0.08 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.787 -179.771 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.786 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 0.1 OUTLIER -160.25 77.55 0.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.553 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.676 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.06 174.35 6.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.232 0.539 . . . . 0.0 111.879 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.674 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -174.03 28.51 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.398 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.848 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 16.0 ttp -124.45 171.15 10.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.688 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.718 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.4 OUTLIER -53.57 138.24 34.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.656 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -43.95 -67.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.514 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -48.15 -34.13 9.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.94 -179.994 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.733 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 47.2 mmm -68.92 -29.83 68.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.862 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.909 ' HB3' HD13 ' A' ' 74' ' ' ILE . 1.6 mm100 -74.21 -39.09 63.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.654 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.852 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 6.9 mt-30 -74.83 -34.23 62.3 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.514 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.3 OUTLIER -73.53 -36.86 65.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.642 178.988 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.712 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 56.6 p -62.91 -47.38 83.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.835 178.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.804 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 26.3 t -57.64 -49.97 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.753 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 40.9 mt-10 -55.14 -38.57 68.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.213 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.69 -37.39 84.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.187 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.691 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -70.93 -27.83 64.05 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 178.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.565 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 5.3 m -73.85 -39.99 63.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.355 178.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.581 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -56.51 -45.36 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.629 178.971 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.978 ' HB1' HG21 ' A' ' 38' ' ' ILE . . . -75.3 -23.38 57.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.752 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.581 HD23 ' CG1' ' A' ' 81' ' ' VAL . 7.0 mt -73.94 -34.02 64.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -94.17 -21.75 18.88 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.533 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.593 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 41.0 mmtm -90.1 -13.16 36.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.676 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.68 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -152.26 -142.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.584 ' HA ' HD12 ' A' ' 38' ' ' ILE . 0.6 OUTLIER 159.88 34.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.501 179.796 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.915 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 33.2 mm -113.97 39.21 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.184 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.785 ' N ' HD11 ' A' ' 38' ' ' ILE . 3.6 mp0 36.69 -87.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.58 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.679 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.06 -43.42 3.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.378 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.915 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.9 t70 -60.45 -57.62 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.335 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.978 HG21 ' HB1' ' A' ' 28' ' ' ALA . 3.2 mt -48.3 -55.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.856 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.792 ' N ' HG12 ' A' ' 58' ' ' VAL . . . -53.1 -46.65 68.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.88 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.752 ' HB3' ' CE1' ' B' ' 65' ' ' TYR . . . -52.03 -54.56 28.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.054 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.801 ' HD1' ' HB3' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -60.82 -55.21 35.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.737 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.812 HD11 HG22 ' A' ' 38' ' ' ILE . 76.3 mt -44.31 -56.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.137 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.847 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.2 OUTLIER -53.42 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.754 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.564 ' HA ' ' OD2' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -35.61 -53.81 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.565 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.2 mm-40 -51.37 -58.94 4.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.78 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.726 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 3.0 m-85 -52.35 -48.6 65.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.786 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.8 ' HB2' ' HB3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -61.54 -19.25 61.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.653 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.412 ' HE3' ' CA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -121.34 12.3 10.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.848 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.0 OUTLIER -124.44 -16.87 6.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.096 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.712 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 27.1 m-85 -140.1 -55.36 0.54 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.801 0.334 . . . . 0.0 111.238 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.712 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 3.5 t30 160.1 119.77 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.169 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.314 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.8 ' HB3' ' HB2' ' A' ' 47' ' ' ASP . 39.4 Cg_endo -67.02 166.87 21.47 Favored 'Trans proline' 0 CA--C 1.532 0.399 0 C-N-CA 122.464 2.109 . . . . 0.0 112.344 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.68 HG22 ' CE1' ' A' ' 55' ' ' HIS . 3.7 m -106.64 128.28 54.04 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 122.817 0.447 . . . . 0.0 110.77 0.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.773 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.7 m95 -94.64 123.38 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.856 -179.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.887 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.0 OUTLIER -106.9 97.69 7.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.588 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.861 ' HB2' HD11 ' A' ' 85' ' ' LEU . 27.7 p -117.5 162.37 18.09 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.909 HD12 ' HA ' ' B' ' 64' ' ' SER . 16.5 mm -129.47 168.48 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.01 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.843 ' H ' HG22 ' A' ' 57' ' ' ILE . 5.9 p -165.04 110.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.899 0.38 . . . . 0.0 111.479 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.759 ' O ' HG12 ' A' ' 81' ' ' VAL . . . -146.48 -128.14 1.9 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.205 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.572 ' HG3' ' NH1' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -167.14 -37.67 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.785 0.326 . . . . 0.0 111.121 -179.755 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -140.16 52.61 1.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.247 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 1.038 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.4 OUTLIER -110.11 168.46 9.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.374 . . . . 0.0 110.758 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.889 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -115.1 81.31 0.3 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.959 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.925 ' HA ' HG12 ' B' ' 57' ' ' ILE . 1.0 OUTLIER -76.06 137.95 40.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.968 0.414 . . . . 0.0 111.472 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.892 ' HB2' ' HB1' ' B' ' 39' ' ' ALA . 9.1 t80 -151.16 65.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.42 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.685 HG11 ' CB ' ' B' ' 55' ' ' HIS . 28.5 m -112.78 161.74 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.187 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.713 HG22 ' N ' ' A' ' 68' ' ' HIS . 2.8 t -81.65 -149.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.952 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.713 ' N ' HG22 ' A' ' 67' ' ' THR . 5.7 p-80 179.59 161.2 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.711 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -161.64 165.07 28.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.041 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.468 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 9.1 m 68.72 -93.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.126 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.586 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER 168.3 67.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.848 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 95.9 m-70 -154.73 16.73 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.979 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 8.8 t80 -99.4 101.0 12.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.37 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.909 HD13 ' HB3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -123.56 118.87 55.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.958 0.408 . . . . 0.0 111.595 -179.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.786 ' HB3' ' HB3' ' A' ' 10' ' ' ASN . 75.9 t80 -112.76 135.03 53.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.111 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.904 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -150.13 176.55 10.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.877 0.37 . . . . 0.0 111.203 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.772 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 7.2 t80 -132.4 99.45 4.68 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.19 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.016 HD11 ' HB2' ' A' ' 6' ' ' ALA . 1.9 mm? -65.24 -174.83 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.329 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.46 ' O ' ' CB ' ' A' ' 80' ' ' GLN . . . -60.18 85.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.062 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.772 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 5.7 tt0 82.68 12.31 0.52 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.807 0.337 . . . . 0.0 110.739 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.868 HG12 ' H ' ' A' ' 82' ' ' ALA . 68.5 t -136.09 173.58 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.853 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.868 ' H ' HG12 ' A' ' 81' ' ' VAL . . . -148.99 154.67 39.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.858 0.361 . . . . 0.0 111.142 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.741 HD11 ' O ' ' A' ' 82' ' ' ALA . 0.4 OUTLIER -139.95 116.08 8.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.037 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.896 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 12.6 tp -97.98 86.52 3.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.785 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.861 HD11 ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -90.48 139.24 30.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.051 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.979 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.0 OUTLIER -172.53 121.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.355 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.807 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.8 OUTLIER -94.21 118.99 32.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.792 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.845 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -85.37 18.98 2.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.311 0.576 . . . . 0.0 110.784 -179.987 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.35 -1.25 . . . . 0.0 112.533 179.876 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.599 ' C ' ' SG ' ' B' ' 2' ' ' CYS . 13.6 mtm . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.797 0.332 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.599 ' SG ' ' C ' ' B' ' 1' ' ' MET . 0.0 OUTLIER -167.9 81.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.91 179.954 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.441 ' HB2' ' OE2' ' B' ' 23' ' ' GLU . 4.0 m-20 -145.2 -4.39 0.71 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.042 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.668 ' HD2' ' OE1' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -80.32 66.43 5.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.765 179.921 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -89.99 36.08 0.86 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.073 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.055 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -110.52 -155.33 0.56 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.055 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.736 HG23 ' O ' ' B' ' 6' ' ' ALA . 6.8 t -158.36 67.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.134 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.898 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.1 mp -35.66 142.84 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 110.153 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.992 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 5.2 mmpt? -120.86 -22.41 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.589 HD21 ' C ' ' B' ' 10' ' ' ASN . 0.2 OUTLIER -150.21 -104.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.308 179.758 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.756 ' CB ' ' HA ' ' B' ' 74' ' ' ILE . . . 69.25 145.34 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.176 0.512 . . . . 0.0 111.743 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.545 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -145.17 25.49 1.39 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.647 179.216 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.633 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 20.1 ttp -102.04 166.47 10.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.989 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.716 ' HB2' ' HG3' ' B' ' 17' ' ' MET . 2.2 m -47.68 143.52 3.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.814 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.602 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 3.4 pt-20 -49.84 -69.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.864 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.756 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -47.34 -21.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.763 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.793 ' HE2' ' CH2' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -82.39 -37.73 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.017 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.866 ' HA ' HD11 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.26 -34.72 68.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.659 179.869 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.668 ' OE1' ' HD2' ' B' ' 4' ' ' ARG . 37.7 mt-30 -77.86 -40.42 40.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.927 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.756 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -69.15 -33.44 73.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.638 179.161 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.911 ' HB2' HD22 ' B' ' 85' ' ' LEU . 0.6 OUTLIER -65.48 -49.28 69.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.154 179.286 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.795 HG23 ' CD2' ' B' ' 76' ' ' PHE . 84.1 t -59.94 -37.11 70.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.162 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . 0.589 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 62.2 mt-10 -63.86 -35.05 79.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.344 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.476 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 3.5 t -72.82 -34.61 66.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 109.798 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.88 ' HA ' HD12 ' B' ' 42' ' ' ILE . . . -72.63 -35.04 67.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.866 ' HA ' HD13 ' B' ' 29' ' ' LEU . 51.7 m -69.83 -43.89 71.05 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.622 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.795 ' HG3' ' N ' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -52.73 -46.84 67.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.526 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.988 ' HB2' HG22 ' B' ' 38' ' ' ILE . . . -71.28 -24.14 62.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.721 178.793 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.908 HD12 ' HG ' ' B' ' 78' ' ' LEU . 3.5 mt -71.34 -36.82 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.543 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -86.74 -28.83 22.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.625 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.771 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 44.7 mmtm -84.25 -27.61 27.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.744 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -148.87 164.49 34.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.662 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . 0.438 ' C ' HD11 ' B' ' 34' ' ' ILE . 9.7 m120 -129.65 31.25 4.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 1.02 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.2 mm -113.7 107.1 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.889 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 13.9 mp0 -31.15 -67.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.545 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.749 ' HZ3' HG21 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -48.57 -60.69 2.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.789 179.594 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 1.02 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.2 m-20 -45.29 -65.1 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.664 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.988 HG22 ' HB2' ' B' ' 28' ' ' ALA . 9.9 mt -41.91 -46.74 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.127 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.892 ' HB1' ' HB2' ' A' ' 65' ' ' TYR . . . -64.88 -42.46 94.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.984 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.731 ' HB1' ' CE1' ' A' ' 65' ' ' TYR . . . -57.85 -59.44 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.156 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.627 ' CE1' ' HB3' ' B' ' 37' ' ' ASP . 0.0 OUTLIER -53.53 -55.06 28.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.661 179.985 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.88 HD12 ' HA ' ' B' ' 25' ' ' ALA . 37.7 mt -45.5 -69.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.677 ' HD2' ' HE2' ' A' ' 65' ' ' TYR . 4.4 tmtt? -45.21 -36.45 3.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.898 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.505 ' O ' ' HE2' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -65.94 -50.01 65.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.977 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.763 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.8 OUTLIER -64.86 -35.88 82.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.912 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.786 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -68.61 -40.52 80.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.029 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.773 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.43 -39.07 85.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.899 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -32.37 34.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.763 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.82 -13.28 39.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.776 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.704 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 98.6 m-85 -123.58 -73.23 0.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.48 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.704 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.6 t-20 159.21 113.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.172 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.773 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 78.5 Cg_exo -42.13 151.06 0.21 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.208 1.939 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.668 HG22 ' HE1' ' B' ' 55' ' ' HIS . 2.8 t -122.41 131.84 54.08 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 122.895 0.478 . . . . 0.0 110.51 0.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 1.028 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 53.3 m95 -96.16 126.01 41.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.716 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.694 ' HD1' ' N ' ' B' ' 55' ' ' HIS . 0.0 OUTLIER -98.13 94.08 6.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.092 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.765 ' HB3' ' CD1' ' B' ' 85' ' ' LEU . 1.8 m -112.61 169.68 8.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.437 0.637 . . . . 0.0 112.015 -177.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.925 HG12 ' HA ' ' A' ' 64' ' ' SER . 32.8 mt -158.34 162.19 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.346 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.864 HG13 ' HB ' ' B' ' 38' ' ' ILE . 2.2 p -159.54 114.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.003 0.43 . . . . 0.0 111.488 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.736 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -143.2 -133.92 2.82 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.942 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -172.88 10.03 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.778 0.323 . . . . 0.0 111.168 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.417 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -174.62 32.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.216 -179.908 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 1.038 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 8.8 p90 -102.81 168.34 9.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.05 0.452 . . . . 0.0 111.142 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -121.79 81.84 0.35 Allowed Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.064 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.909 ' HA ' HD12 ' A' ' 57' ' ' ILE . 8.7 p -75.88 123.27 25.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.959 0.409 . . . . 0.0 111.324 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.847 ' HE2' ' HD2' ' A' ' 43' ' ' LYS . 10.8 t80 -134.85 68.88 1.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.507 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.887 ' HB ' ' HB3' ' A' ' 55' ' ' HIS . 4.6 m -114.88 150.99 16.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.457 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 16.3 m -87.37 95.99 10.2 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.857 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.793 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 10.6 p-80 -61.87 159.08 14.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.546 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -152.65 -171.6 3.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.614 179.98 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.586 ' C ' ' H ' ' B' ' 72' ' ' HIS . 29.8 m 51.68 -119.54 1.47 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.413 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.48 ' H ' ' CG2' ' B' ' 70' ' ' THR . 55.5 mmtt -72.95 31.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 0.0 110.202 179.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.793 ' O ' ' HB2' ' B' ' 68' ' ' HIS . 63.2 m-70 61.49 -93.67 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.496 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.793 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 159.4 -161.06 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.866 HD11 ' HA ' ' B' ' 18' ' ' GLN . 0.5 OUTLIER -165.3 111.66 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.049 179.24 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.549 ' HE1' ' HZ ' ' B' ' 62' ' ' PHE . 9.6 t80 -110.12 98.27 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.898 ' HB3' HG13 ' B' ' 8' ' ' ILE . 3.6 p90 -118.58 169.67 9.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.617 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 31.2 t80 -132.27 113.21 12.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.522 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.055 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -70.39 169.87 13.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.73 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.509 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -24.76 -47.63 0.02 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.117 -0.564 . . . . 0.0 113.218 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.508 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -145.71 29.83 1.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.644 0.259 . . . . 0.0 111.142 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.775 HG11 ' N ' ' B' ' 82' ' ' ALA . 97.1 t -143.61 170.11 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.285 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.775 ' N ' HG11 ' B' ' 81' ' ' VAL . . . -137.1 126.09 24.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.552 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.657 ' CG1' HD22 ' B' ' 78' ' ' LEU . 0.3 OUTLIER -114.66 124.05 70.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.134 0.493 . . . . 0.0 111.832 -179.399 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.761 ' O ' ' HA ' ' B' ' 56' ' ' CYS . 0.2 OUTLIER -106.85 93.96 4.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.039 179.655 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.911 HD22 ' HB2' ' B' ' 21' ' ' SER . 0.5 OUTLIER -100.43 122.86 43.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.276 -179.414 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.671 ' CE1' HG22 ' B' ' 66' ' ' VAL . 18.3 p90 -163.83 115.06 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.319 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 1.028 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 5.6 ptmt -105.02 158.32 16.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.684 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.546 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.6 OUTLIER -95.52 19.45 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.229 0.538 . . . . 0.0 110.869 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . 0.747 ' HA2' ' CE ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.47 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.854 0.359 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.6 ' SG ' HG21 ' A' ' 26' ' ' THR . 4.5 t 64.97 156.43 0.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.728 -179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -84.72 -149.91 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.78 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . 0.455 ' O ' HG13 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -98.37 -46.58 5.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.874 -179.972 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.584 ' O ' HD11 ' A' ' 78' ' ' LEU . 0.1 OUTLIER 39.06 38.87 0.34 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.17 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.046 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -141.67 173.34 11.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.244 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.467 ' O ' ' HE3' ' A' ' 9' ' ' LYS . 39.0 t -139.05 75.78 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.033 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.833 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -38.89 160.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.13 0.49 . . . . 0.0 110.637 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.739 ' HD3' ' O ' ' A' ' 8' ' ' ILE . 2.8 mmtp -159.44 -6.96 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.63 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.477 ' CG ' ' HZ ' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -167.51 71.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.393 179.984 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.879 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -117.5 92.36 3.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.664 -179.458 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.795 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 53.7 m-20 -90.53 26.41 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.154 0.502 . . . . 0.0 110.246 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.773 ' HG3' ' H ' ' A' ' 14' ' ' SER . 16.0 ttp -109.85 173.33 6.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.773 ' H ' ' HG3' ' A' ' 13' ' ' MET . 1.2 t -57.91 140.85 51.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.86 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.561 ' HA ' ' CG ' ' A' ' 18' ' ' GLN . 11.9 mt-10 -47.98 -62.91 1.23 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.967 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.481 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 1.1 mt-10 -51.68 -31.62 26.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.56 ' HE2' ' CH2' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -72.57 -45.59 58.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.81 HE21 ' HB3' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -62.4 -36.86 83.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.943 179.957 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.555 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 10.2 mt-30 -73.57 -35.17 65.43 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.851 ' HB3' ' HH ' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -74.05 -27.74 61.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.699 178.917 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.4 t -71.22 -41.03 70.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.06 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.802 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 94.7 t -65.58 -46.67 88.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.613 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.703 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 58.2 mt-10 -57.97 -41.7 83.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.114 179.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 20.3 m -64.35 -37.04 86.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.758 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.803 ' HA ' HD12 ' A' ' 42' ' ' ILE . . . -69.99 -32.56 70.82 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.683 ' HA ' HD13 ' A' ' 29' ' ' LEU . 1.6 m -69.27 -38.82 78.56 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.47 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.773 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 57.5 mt-30 -59.22 -41.01 87.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.943 179.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 1.068 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -73.21 -31.72 64.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.132 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.683 HD13 ' HA ' ' A' ' 26' ' ' THR . 1.3 mt -72.13 -35.68 69.18 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.327 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -93.17 -11.78 31.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.352 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.773 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 8.4 mttm -96.43 -19.82 18.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.723 0.297 . . . . 0.0 111.216 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.593 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -151.46 -62.77 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.031 179.955 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.802 ' HA ' HD13 ' A' ' 38' ' ' ILE . 5.7 t-20 74.83 61.12 0.07 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.75 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 1.038 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 44.3 mm -141.21 57.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.011 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.628 ' O ' HG13 ' A' ' 58' ' ' VAL . 1.5 mp0 31.87 -91.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.974 0.416 . . . . 0.0 110.266 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.654 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -44.02 -54.03 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.214 179.105 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 1.038 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -52.26 -58.29 7.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.978 179.632 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 1.068 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 24.5 mt -48.22 -43.42 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.939 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.989 ' HB3' ' HB2' ' B' ' 65' ' ' TYR . . . -62.22 -49.62 75.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.765 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.805 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -53.26 -45.74 68.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.776 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.808 ' CD2' ' HB3' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -57.2 -58.44 8.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.622 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.803 HD12 ' HA ' ' A' ' 25' ' ' ALA . 8.0 mt -50.42 -74.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.367 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.729 ' HD3' ' CD2' ' B' ' 65' ' ' TYR . 7.6 tttt -39.11 -40.62 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.799 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.577 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.21 -62.36 1.7 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.038 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -60.48 -58.95 6.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.871 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.814 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.9 OUTLIER -42.02 -38.19 1.57 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.78 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -69.35 -43.74 73.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.837 -179.855 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.99 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -95.94 9.78 39.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.316 -179.844 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -129.96 -5.54 4.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.119 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.851 ' HH ' ' HB3' ' A' ' 20' ' ' ASP . 75.9 m-85 -138.39 -61.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.224 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.517 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.6 OUTLIER 158.8 109.62 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.223 -179.708 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.78 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 51.7 Cg_exo -54.23 148.81 39.26 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.39 2.06 . . . . 0.0 112.734 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.576 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.2 OUTLIER -117.42 144.12 45.31 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.882 0.473 . . . . 0.0 110.731 -0.021 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.633 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 70.7 m95 -101.19 114.88 29.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.499 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.79 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -86.3 92.31 8.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.812 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.76 ' HB3' HD11 ' A' ' 85' ' ' LEU . 0.4 OUTLIER -106.81 144.36 33.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.233 0.539 . . . . 0.0 112.293 -178.412 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.896 HG12 HD22 ' A' ' 84' ' ' LEU . 14.5 mm -132.81 107.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.341 179.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.997 HG21 HG23 ' A' ' 38' ' ' ILE . 3.1 p -107.47 129.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.954 0.407 . . . . 0.0 111.479 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.759 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.98 -127.07 1.06 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.057 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.508 ' O ' ' HE2' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -160.56 -54.48 0.05 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 120.746 0.307 . . . . 0.0 111.23 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.818 ' HB3' ' CZ ' ' B' ' 60' ' ' ARG . 0.1 OUTLIER -130.94 67.54 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.084 -179.792 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.808 ' HE2' ' HB3' ' A' ' 64' ' ' SER . 1.4 p90 -122.57 -166.02 1.37 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.872 0.368 . . . . 0.0 110.861 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.601 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -138.07 75.51 0.38 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.029 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.849 ' HG ' HD11 ' A' ' 84' ' ' LEU . 73.8 p -67.86 133.71 49.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.828 0.347 . . . . 0.0 111.177 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.863 ' HB2' ' HB1' ' B' ' 39' ' ' ALA . 16.1 t80 -151.42 79.54 1.29 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.897 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.699 HG23 ' CD1' ' A' ' 86' ' ' PHE . 21.2 m -110.09 176.67 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.039 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.793 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 55.1 m -107.01 108.97 20.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.83 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.605 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -57.89 157.39 7.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 179.938 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.725 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 9.9 mm-40 -136.96 -125.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.923 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.482 ' O ' ' O ' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -30.18 -97.61 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.225 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.541 ' HD3' ' SD ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -78.94 46.55 0.7 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.521 -179.972 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.795 ' ND1' ' HB3' ' A' ' 12' ' ' ASP . 18.8 m170 47.48 -90.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.623 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.749 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 4.7 p90 163.13 -160.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.594 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.879 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -168.08 129.8 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.581 179.743 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.547 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 15.4 t80 -123.19 136.14 54.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.612 178.718 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.833 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.2 OUTLIER -154.57 168.87 25.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.996 0.427 . . . . 0.0 111.193 -179.314 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.696 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 11.7 t80 -127.1 99.09 5.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.187 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.046 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -65.91 -175.06 0.27 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 179.76 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.436 ' O ' ' HB3' ' A' ' 80' ' ' GLN . . . -58.11 86.78 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.978 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.436 ' HB3' ' O ' ' A' ' 79' ' ' GLY . 48.0 tt0 78.01 23.25 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 0.0 110.195 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 59' ' ' GLY . 45.5 t -141.97 167.13 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.782 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.696 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -146.43 118.58 8.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.872 HG12 HD23 ' A' ' 78' ' ' LEU . 0.5 OUTLIER -105.11 139.99 24.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.973 0.416 . . . . 0.0 111.609 -179.53 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.938 HD23 HD12 ' B' ' 57' ' ' ILE . 0.7 OUTLIER -124.7 94.53 4.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.378 179.644 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.76 HD11 ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -99.6 129.14 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.556 -179.318 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.79 ' CE1' ' HB2' ' A' ' 55' ' ' HIS . 1.4 p90 -166.32 119.37 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.909 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.633 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -105.82 151.79 24.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.067 -179.949 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.725 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.1 OUTLIER -98.4 18.33 16.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.175 0.512 . . . . 0.0 110.809 179.925 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.443 ' HA2' HG21 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.454 -1.192 . . . . 0.0 112.474 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.862 ' HG2' ' H ' ' B' ' 2' ' ' CYS . 28.6 ttm . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.873 0.368 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . 0.862 ' H ' ' HG2' ' B' ' 1' ' ' MET . 5.1 m -91.17 179.15 5.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.894 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . 0.611 ' HB2' ' O ' ' B' ' 2' ' ' CYS . 1.2 m-20 75.32 176.5 0.22 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.73 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.58 ' NH1' ' HG3' ' B' ' 4' ' ' ARG . 3.2 mmm-85 -37.78 -96.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.937 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.71 ' O ' HD11 ' B' ' 78' ' ' LEU . 0.0 OUTLIER 77.62 98.27 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.689 -179.869 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.035 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.03 -168.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.767 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.8 HG13 ' HE2' ' B' ' 9' ' ' LYS . 99.5 t -152.78 75.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.252 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.974 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -51.01 145.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.114 0.483 . . . . 0.0 110.419 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.8 ' HE2' HG13 ' B' ' 7' ' ' VAL . 0.5 OUTLIER -142.16 -10.3 0.87 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.156 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.551 ' CG ' ' HZ ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -162.54 72.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.564 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.966 ' HB3' HG13 ' B' ' 74' ' ' ILE . . . -113.05 90.53 3.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.543 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.661 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 21.5 m-20 -90.92 26.96 1.94 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.1 0.476 . . . . 0.0 110.334 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.74 ' HG3' ' H ' ' B' ' 14' ' ' SER . 13.7 ttp -111.2 170.63 7.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.89 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.842 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 40.8 t -53.84 128.57 30.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.664 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 20.1 mt-10 -37.63 -68.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.896 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -46.51 -27.7 1.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.827 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.842 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -73.88 -45.77 48.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.976 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.691 ' HG2' ' O ' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -62.18 -30.03 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.555 ' HG2' ' HD3' ' B' ' 4' ' ' ARG . 74.5 mt-30 -77.84 -41.59 36.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.052 0.453 . . . . 0.0 109.908 179.504 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.47 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -69.24 -29.26 67.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.712 179.177 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.829 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 13.9 t -68.72 -48.7 63.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.184 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.852 HG12 ' HB1' ' B' ' 6' ' ' ALA . 74.2 t -57.58 -43.8 83.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.404 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.5 -35.35 77.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.806 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 90.9 m -71.35 -35.22 71.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.738 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.959 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -71.61 -32.25 67.8 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 90.9 m -72.1 -42.23 66.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.372 -1.286 . . . . 0.0 109.663 178.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.579 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -52.72 -46.42 67.38 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.241 178.811 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.84 ' HB3' ' HA ' ' B' ' 38' ' ' ILE . . . -64.76 -38.18 90.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.887 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.773 HD13 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -64.07 -33.23 75.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.617 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -78.71 -32.09 46.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.764 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.579 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 5.8 mmtt -85.54 -19.91 30.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.654 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.524 ' HE1' ' ND1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -165.98 164.37 18.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.776 179.677 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -124.55 27.99 6.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.756 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.814 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.7 mm -104.5 107.86 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.938 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.75 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 0.9 OUTLIER -30.31 -70.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.411 ' H ' ' HG2' ' B' ' 36' ' ' LYS . 1.8 mmmt -44.71 -49.26 10.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.814 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.4 OUTLIER -55.89 -61.02 2.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 179.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.84 ' HA ' ' HB3' ' B' ' 28' ' ' ALA . 2.5 mt -46.22 -56.86 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.931 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.863 ' HB1' ' HB2' ' A' ' 65' ' ' TYR . . . -44.83 -46.69 10.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.606 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.763 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -65.24 -65.49 0.67 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.436 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.588 ' NE2' ' OE2' ' B' ' 45' ' ' GLU . 1.8 t60 -37.09 -34.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.76 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.86 HG21 HD11 ' B' ' 85' ' ' LEU . 39.5 mt -73.46 -66.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.938 179.758 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.857 ' HG2' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -48.5 -24.02 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.503 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.503 ' N ' ' HD3' ' B' ' 43' ' ' LYS . 2.7 tttm -74.89 -58.38 3.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.793 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.769 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 4.1 mt-10 -62.84 -30.67 71.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.68 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.829 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -69.88 -43.29 72.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.836 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.797 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -63.22 -36.99 85.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.129 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -89.94 -24.07 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.714 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.769 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.46 -13.19 35.32 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.402 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.57 ' HD1' ' O ' ' B' ' 46' ' ' PHE . 2.6 m-85 -126.75 -71.59 0.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.461 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 3.7 m-20 162.02 113.8 0.01 OUTLIER Pre-proline 0 N--CA 1.453 -0.309 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.797 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 44.7 Cg_exo -35.63 148.25 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.523 2.149 . . . . 0.0 112.7 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.702 ' O ' ' HB3' ' B' ' 87' ' ' LYS . 2.1 m -123.98 136.73 54.49 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.102 0.561 . . . . 0.0 110.258 -0.145 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.784 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 62.5 m95 -103.03 129.0 49.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.211 0.529 . . . . 0.0 112.254 -178.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.82 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 7.8 m-70 -112.33 115.88 29.46 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.777 ' HB3' ' CD1' ' B' ' 85' ' ' LEU . 0.0 OUTLIER -134.32 170.32 15.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.693 0.758 . . . . 0.0 112.687 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.938 HD12 HD23 ' A' ' 84' ' ' LEU . 43.8 mt -149.54 165.94 3.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.341 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.847 HG13 ' N ' ' B' ' 39' ' ' ALA . 2.4 p -161.06 116.02 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 0.0 111.13 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.716 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.38 -113.04 1.22 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.234 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.818 ' CZ ' ' HB3' ' A' ' 61' ' ' ASN . 0.0 OUTLIER 174.59 -4.6 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 120.579 0.228 . . . . 0.0 111.59 -179.594 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.571 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -170.86 34.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.434 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' B' ' 63' ' ' GLY . 9.5 p90 -99.84 -169.61 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.092 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.654 ' HA3' ' N ' ' A' ' 36' ' ' LYS . . . -147.5 96.69 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.742 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.887 ' HA ' HD12 ' A' ' 57' ' ' ILE . 8.8 p -81.46 149.15 28.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.141 0.496 . . . . 0.0 111.78 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.989 ' HB2' ' HB3' ' A' ' 39' ' ' ALA . 15.9 t80 -152.2 69.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.147 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.84 HG12 HD11 ' A' ' 57' ' ' ILE . 10.2 m -114.68 150.25 16.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.322 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.576 HG21 ' CG2' ' A' ' 53' ' ' THR . 5.2 t -77.26 119.49 20.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.082 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.683 ' H ' ' ND1' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -83.72 148.05 27.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.71 179.807 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.739 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.88 -105.44 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.163 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.599 ' CG2' ' HB2' ' B' ' 87' ' ' LYS . 0.2 OUTLIER -37.54 -101.58 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.479 -179.728 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.601 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 2.9 mmtp -80.81 55.91 2.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.789 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.723 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 9.5 m80 30.99 -89.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.894 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.769 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 0.2 OUTLIER 165.18 -179.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.519 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.966 HG13 ' HB3' ' B' ' 11' ' ' ALA . 1.1 tt -151.83 115.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.703 ' HE2' ' HG ' ' B' ' 64' ' ' SER . 0.9 OUTLIER -111.39 92.76 4.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.812 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.974 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.2 p90 -111.04 168.85 9.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.627 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 49.1 t80 -130.64 112.98 13.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.618 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.035 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -69.16 170.36 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.75 -48.74 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.781 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.501 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 0.7 OUTLIER -145.95 37.57 1.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.862 0.363 . . . . 0.0 110.987 179.814 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.753 HG13 ' H ' ' B' ' 82' ' ' ALA . 69.5 t -154.68 169.08 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.01 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.753 ' H ' HG13 ' B' ' 81' ' ' VAL . . . -128.6 157.74 40.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.664 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.959 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -145.07 117.12 2.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.979 0.419 . . . . 0.0 111.548 -179.702 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.747 HD13 ' HB2' ' B' ' 64' ' ' SER . 0.1 OUTLIER -106.74 92.29 4.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.177 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.86 HD11 HG21 ' B' ' 42' ' ' ILE . 0.2 OUTLIER -96.3 143.74 27.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.529 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.719 ' CD2' HG23 ' B' ' 66' ' ' VAL . 2.4 p90 179.17 136.97 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.729 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.784 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -103.74 162.88 12.72 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.647 179.506 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.82 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.4 OUTLIER -119.52 21.02 12.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.797 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.495 -179.954 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.56 ' O ' ' HB2' ' A' ' 2' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.847 0.356 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.56 ' HB2' ' O ' ' A' ' 1' ' ' MET . 42.3 t 170.24 -12.6 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.783 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -131.82 -81.57 0.51 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.891 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 70.68 -101.11 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.054 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . 0.606 ' O ' HD12 ' A' ' 78' ' ' LEU . 0.2 OUTLIER 61.31 30.03 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.645 -179.865 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 1.064 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.11 -165.48 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.398 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.75 HG11 ' HE2' ' A' ' 9' ' ' LYS . 79.4 t -155.21 73.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ILE . . . . . 0.972 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.52 158.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.191 0.52 . . . . 0.0 110.77 -179.515 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.765 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 6.9 mmtt -156.87 -11.91 0.09 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.1 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASN . . . . . 0.501 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.1 OUTLIER -169.39 87.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.502 -179.817 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.993 ' HB1' HG13 ' A' ' 74' ' ' ILE . . . -123.61 95.77 4.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.836 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.776 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 8.4 m-20 -84.78 36.49 0.61 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.275 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.846 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 14.2 ttp -125.19 164.41 20.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.051 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.629 ' H ' ' HG3' ' A' ' 13' ' ' MET . 52.8 p -55.81 123.89 15.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.833 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 8.8 mt-10 -29.35 -68.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.351 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -44.38 -41.83 6.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' MET . . . . . 0.788 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -65.69 -31.02 71.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.143 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.833 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -71.74 -34.54 69.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.023 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.543 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -75.27 -40.45 58.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.198 0.523 . . . . 0.0 110.043 179.603 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.37 -26.27 62.72 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.825 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.828 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 35.1 t -71.34 -43.74 66.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.197 179.302 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.792 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 40.5 t -61.01 -46.2 97.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.354 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 64.9 mt-10 -57.68 -43.11 84.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.312 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.559 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 3.3 m -64.21 -36.62 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.199 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.995 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -69.83 -33.47 72.34 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.67 ' HA ' HD11 ' A' ' 29' ' ' LEU . 24.0 m -68.86 -38.09 79.5 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.154 -1.384 . . . . 0.0 109.675 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.752 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 21.7 mm100 -60.34 -40.67 91.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.98 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.94 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -69.28 -33.58 73.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.743 179.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.772 HD11 ' O ' ' A' ' 25' ' ' ALA . 1.2 mt -67.94 -45.93 72.9 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -26.5 65.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.714 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.752 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 5.9 mttp -88.75 -25.72 22.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.844 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.523 ' HE1' ' CB ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -160.07 140.66 11.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.584 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -103.57 30.15 5.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 0.0 110.946 -179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.972 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.9 mm -112.5 104.81 17.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.112 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.948 ' HA ' HD13 ' A' ' 38' ' ' ILE . 13.2 mp0 -24.34 -79.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.2 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.64 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.2 OUTLIER -40.19 -48.07 2.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.766 179.737 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.972 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -56.8 -54.66 43.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.793 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 1.008 HG23 HD11 ' A' ' 42' ' ' ILE . 2.8 mt -50.46 -48.82 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.86 ' N ' HG11 ' A' ' 58' ' ' VAL . . . -55.46 -61.98 1.98 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.846 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.809 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -39.81 -59.67 1.13 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.806 ' CD2' ' HB3' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -49.45 -51.54 34.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.206 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 1.008 HD11 HG23 ' A' ' 38' ' ' ILE . 8.2 mt -54.04 -65.31 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.225 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.735 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 22.6 tttm -46.86 -69.47 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.066 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 44' ' ' LYS . 15.3 mmtt -33.18 -59.0 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.969 -179.774 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.732 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 3.8 tp10 -65.08 -30.67 71.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.706 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.828 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -79.1 -7.48 58.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.244 -179.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.816 ' HB3' ' HB3' ' A' ' 52' ' ' PRO . 7.0 m-20 -101.45 -29.07 12.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.158 0.504 . . . . 0.0 110.04 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.579 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -93.76 -23.38 18.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.867 179.805 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.732 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -89.48 -17.27 28.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.217 -179.676 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.755 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 4.2 m-85 -137.91 -64.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.338 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.755 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 0.1 OUTLIER 157.24 119.05 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.113 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.754 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.816 ' HB3' ' HB3' ' A' ' 47' ' ' ASP . 39.5 Cg_endo -66.07 170.47 11.71 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 122.56 2.174 . . . . 0.0 112.465 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.751 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 0.3 OUTLIER -104.4 132.39 50.7 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.834 0.453 . . . . 0.0 110.634 -0.147 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TRP . . . . . 0.761 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 42.7 m95 -99.78 92.46 5.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.298 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . 0.778 ' HB3' HG13 ' B' ' 66' ' ' VAL . 2.4 m170 -62.12 88.85 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.771 ' HA ' ' O ' ' A' ' 84' ' ' LEU . 0.7 OUTLIER -103.66 131.08 51.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.306 -178.232 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 1.032 HD12 ' HA ' ' B' ' 64' ' ' SER . 19.3 mm -123.7 100.31 7.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.566 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.86 HG11 ' N ' ' A' ' 39' ' ' ALA . 3.0 p -98.71 118.43 45.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.845 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -138.72 -128.66 2.6 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.847 -0.692 . . . . 0.0 111.902 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.538 ' HE ' ' HB3' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -165.75 -1.59 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.762 0.315 . . . . 0.0 111.051 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.595 HD21 ' HE ' ' B' ' 60' ' ' ARG . 16.8 t30 174.72 35.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.924 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.81 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 6.7 p90 -87.08 166.56 14.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.051 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.863 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -116.35 84.32 0.36 Allowed Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.896 ' HB2' HD22 ' A' ' 84' ' ' LEU . 90.0 p -80.84 125.19 29.78 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.105 0.479 . . . . 0.0 111.947 -178.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.982 ' HB2' ' HB3' ' B' ' 39' ' ' ALA . 36.5 t80 -131.42 66.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.708 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.735 ' CG1' ' HB3' ' B' ' 55' ' ' HIS . 3.0 m -99.8 172.67 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.266 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.669 HG21 HG23 ' B' ' 53' ' ' THR . 15.5 m -111.02 72.98 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.703 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' HIS . . . . . 0.509 ' NE2' ' OD2' ' A' ' 12' ' ' ASP . 24.1 p-80 -56.44 -164.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.205 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.462 ' N ' ' CD2' ' A' ' 68' ' ' HIS . 11.4 pt-20 168.37 -153.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.667 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.474 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER 51.88 -99.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.769 ' O ' ' HA ' ' A' ' 13' ' ' MET . 3.0 pttt 173.67 20.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.79 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.846 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 62.7 m-70 -121.78 43.72 2.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.757 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . 0.776 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 3.7 t80 -116.06 110.7 19.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.499 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.993 HG13 ' HB1' ' A' ' 11' ' ' ALA . 1.3 tt -123.65 127.12 73.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.317 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ASN . 58.6 t80 -120.96 110.12 15.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.451 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.972 ' HB3' HG13 ' A' ' 8' ' ' ILE . 2.2 p90 -135.68 173.89 11.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.24 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.712 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 28.4 t80 -127.23 113.95 17.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.052 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 1.064 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -78.4 -178.3 5.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.684 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . 0.626 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -60.42 90.82 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.074 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLN . . . . . 0.712 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 31.6 mt-30 78.19 21.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.865 0.364 . . . . 0.0 110.622 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.685 HG13 ' O ' ' A' ' 59' ' ' GLY . 90.0 t -151.2 171.54 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.881 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.672 ' N ' HG11 ' A' ' 81' ' ' VAL . . . -147.95 153.61 39.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.013 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.692 HD13 HG21 ' A' ' 58' ' ' VAL . 0.3 OUTLIER -136.29 127.29 42.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.134 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.896 HD22 ' HB2' ' A' ' 64' ' ' SER . 4.1 tp -111.69 86.6 2.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.651 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.706 HD12 ' CB ' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -93.34 125.99 38.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 -179.67 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.757 ' HB3' ' CD1' ' A' ' 73' ' ' PHE . 7.5 p90 -166.72 134.74 2.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . 0.751 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.99 -162.16 0.88 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.648 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' SER . . . . . 0.45 ' HA ' ' OE2' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -146.6 18.84 1.32 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.176 0.512 . . . . 0.0 110.981 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLY . . . . . 0.416 ' HA2' HG22 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.248 1.028 0 CA-C-O 118.436 -1.202 . . . . 0.0 112.599 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 22.7 mmt . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.756 0.313 . . . . 0.0 111.221 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' CYS . . . . . . . . . . . . . 69.6 m 39.98 90.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.803 179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -50.63 -16.43 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.85 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' ARG . . . . . 0.641 ' O ' HG11 ' B' ' 22' ' ' VAL . 6.6 mmt85 -55.69 -56.14 23.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.717 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' LYS . . . . . 0.437 ' HZ3' ' HG2' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 62.07 -174.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.894 179.798 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . 1.003 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 71.77 170.11 0.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.447 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' VAL . . . . . 0.603 ' N ' ' O ' ' B' ' 77' ' ' TYR . 89.6 t -134.65 66.96 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.369 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ILE . . . . . 0.754 ' HA ' ' O ' ' B' ' 75' ' ' TYR . 0.8 OUTLIER -28.95 140.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.917 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' B' ' 7' ' ' VAL . 5.7 mmtt -132.13 -0.36 3.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.628 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' B' ' 9' ' ' LYS . 0.1 OUTLIER 171.56 87.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.733 -179.914 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.904 ' HB1' HG13 ' B' ' 74' ' ' ILE . . . -119.4 89.86 3.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.57 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' ASP . . . . . 0.625 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -91.02 30.05 1.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.459 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.675 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -117.7 168.42 10.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.761 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' SER . . . . . 0.849 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 0.4 OUTLIER -43.02 141.63 1.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.977 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' GLU . . . . . 0.749 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -52.49 -58.28 7.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.674 179.718 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' GLU . . . . . 0.747 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -57.79 -26.3 61.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.51 179.624 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' MET . . . . . 0.849 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -74.27 -44.3 53.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' GLN . . . . . 0.749 ' OE1' ' HA ' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -65.46 -37.29 86.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.603 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -75.32 -41.06 57.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.635 179.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' ASP . . . . . 0.822 ' HB3' ' HH ' ' B' ' 50' ' ' TYR . 0.4 OUTLIER -69.81 -27.96 65.32 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.482 178.839 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' SER . . . . . 0.776 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -67.37 -47.35 70.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.091 179.173 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.993 HG12 ' HB2' ' B' ' 6' ' ' ALA . 73.9 t -58.22 -48.65 84.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.438 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -56.1 -39.32 71.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.404 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' CYS . . . . . 0.531 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -65.61 -36.02 82.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.985 0.421 . . . . 0.0 110.045 179.319 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.73 ' HB2' HG23 ' B' ' 83' ' ' ILE . . . -68.81 -35.68 77.3 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.856 ' HA ' HD13 ' B' ' 29' ' ' LEU . 4.1 m -65.45 -44.25 87.81 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.744 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' GLN . . . . . 0.734 ' O ' ' HD2' ' B' ' 31' ' ' LYS . 10.6 mm100 -51.99 -49.32 63.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.686 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' ALA . . . . . 0.826 ' HB2' HG21 ' B' ' 38' ' ' ILE . . . -75.42 -16.13 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.605 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.946 HD12 ' HG ' ' B' ' 78' ' ' LEU . 5.2 mt -82.12 -33.8 29.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.246 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -85.11 -33.66 22.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.386 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . 0.734 ' HD2' ' O ' ' B' ' 27' ' ' GLN . 0.1 OUTLIER -78.68 -29.25 45.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.952 0.406 . . . . 0.0 110.548 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' TYR . . . . . 0.63 ' CD1' ' N ' ' B' ' 32' ' ' TYR . 0.0 OUTLIER -149.39 151.65 34.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.64 179.789 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -115.29 30.54 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.957 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' ILE . . . . . 0.955 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.1 mm -109.29 106.83 21.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' GLU . . . . . 0.863 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.0 mm-40 -31.6 -70.21 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.9 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' LYS . . . . . 0.489 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 5.2 mtmm -45.91 -61.05 1.9 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.873 0.368 . . . . 0.0 110.594 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' ASP . . . . . 0.955 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.1 m-20 -44.68 -63.6 0.87 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.765 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . 0.826 HG21 ' HB2' ' B' ' 28' ' ' ALA . 4.4 mt -43.63 -57.28 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.141 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' ALA . . . . . 0.982 ' HB3' ' HB2' ' A' ' 65' ' ' TYR . . . -49.14 -41.55 36.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.796 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -59.96 -64.49 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.059 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' HIS . . . . . 0.749 ' HD1' ' HB1' ' B' ' 28' ' ' ALA . 0.2 OUTLIER -47.34 -39.37 14.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.99 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' ILE . . . . . 0.6 HG23 HD13 ' B' ' 85' ' ' LEU . 81.9 mt -59.1 -60.98 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.973 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.818 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.1 OUTLIER -46.34 -55.58 7.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.893 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . 0.584 ' O ' ' HB3' ' B' ' 48' ' ' LYS . 0.1 OUTLIER -53.85 -35.79 61.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 -179.893 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . 0.749 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 5.2 mm-40 -74.43 -40.32 62.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.368 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' PHE . . . . . 0.776 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.77 -35.03 72.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 110.715 179.99 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' ASP . . . . . 0.774 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.9 m-20 -74.18 -31.47 62.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.0 109.91 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' LYS . . . . . 0.584 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -90.0 -24.17 21.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.663 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' LYS . . . . . 0.749 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.24 -30.41 17.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.822 ' HH ' ' HB3' ' B' ' 20' ' ' ASP . 28.4 m-85 -123.85 -59.55 1.51 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.599 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' ASN . . . . . 0.503 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER 155.32 118.92 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.097 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.093 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' PRO . . . . . 0.774 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 18.1 Cg_endo -58.15 167.97 4.07 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.44 2.094 . . . . 0.0 112.502 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' THR . . . . . 0.669 HG23 HG21 ' A' ' 67' ' ' THR . 11.3 t -110.71 120.03 41.06 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.749 0.42 . . . . 0.0 110.653 0.032 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' TRP . . . . . 0.824 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 27.6 m95 -92.7 117.01 29.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.918 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' HIS . . . . . 0.735 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 0.4 OUTLIER -85.15 91.33 8.1 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.928 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' CYS . . . . . 0.818 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 5.7 p -101.8 150.5 23.09 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -177.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' ILE . . . . . 0.885 HG13 HD22 ' B' ' 84' ' ' LEU . 13.3 mm -130.56 159.34 42.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.883 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' VAL . . . . . 0.787 HG11 ' HB1' ' B' ' 39' ' ' ALA . 2.3 p -162.03 108.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.89 0.376 . . . . 0.0 111.046 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' GLY . . . . . 0.728 ' O ' HG12 ' B' ' 81' ' ' VAL . . . -129.21 -133.93 3.7 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.953 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' ARG . . . . . 0.595 ' HE ' HD21 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -165.83 -9.17 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.707 0.289 . . . . 0.0 111.36 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' ASN . . . . . 0.538 ' HB3' ' HE ' ' A' ' 60' ' ' ARG . 0.6 OUTLIER -170.54 34.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.367 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.891 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 17.5 p90 -103.05 -168.61 1.54 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 0.0 110.682 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' GLY . . . . . 0.837 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -143.33 106.12 0.41 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.041 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 1.032 ' HA ' HD12 ' A' ' 57' ' ' ILE . 63.1 p -89.81 134.93 33.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.082 0.467 . . . . 0.0 111.47 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' TYR . . . . . 0.809 ' CE2' ' HA ' ' A' ' 40' ' ' ALA . 56.3 t80 -144.96 79.34 1.59 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.997 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.878 HG11 HD11 ' A' ' 57' ' ' ILE . 4.9 m -131.51 166.75 27.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.565 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' THR . . . . . 0.448 HG21 HG23 ' A' ' 53' ' ' THR . 1.6 t -79.32 170.11 17.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.584 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' HIS . . . . . 0.808 ' HB3' ' CD2' ' B' ' 73' ' ' PHE . 2.4 p-80 -129.85 154.9 46.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' GLU . . . . . 0.739 ' HG3' ' HG ' ' B' ' 88' ' ' SER . 0.0 OUTLIER -143.32 170.41 15.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.815 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' THR . . . . . 0.478 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 44.49 -95.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.122 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' LYS . . . . . 0.617 ' O ' ' HB2' ' B' ' 13' ' ' MET . 7.1 mmtt -92.17 35.05 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.098 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' HIS . . . . . 0.747 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 13.5 m-70 51.08 -85.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.084 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . 0.808 ' CD2' ' HB3' ' B' ' 68' ' ' HIS . 0.3 OUTLIER 165.52 -166.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.706 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.904 HG13 ' HB1' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -162.22 124.38 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.99 0.424 . . . . 0.0 111.666 179.529 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' TYR . . . . . 0.754 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 0.5 OUTLIER -113.82 146.38 40.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.92 178.87 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . 0.803 ' HE1' HG23 ' B' ' 74' ' ' ILE . 1.4 p90 -170.33 149.15 3.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.849 0.357 . . . . 0.0 111.184 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' TYR . . . . . 0.603 ' O ' ' N ' ' B' ' 7' ' ' VAL . 1.3 t80 -113.99 112.03 22.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.83 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' LEU . . . . . 1.003 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -69.18 169.67 11.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.555 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' GLY . . . . . 0.49 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.53 -42.64 0.02 OUTLIER Glycine 0 CA--C 1.518 0.232 0 C-N-CA 121.088 -0.577 . . . . 0.0 112.89 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' GLN . . . . . 0.712 HE21 ' HA ' ' B' ' 80' ' ' GLN . 0.0 OUTLIER -153.55 40.1 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.971 0.415 . . . . 0.0 110.618 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' VAL . . . . . 0.884 HG12 ' H ' ' B' ' 82' ' ' ALA . 77.9 t -156.4 168.46 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.055 -179.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' ALA . . . . . 0.884 ' H ' HG12 ' B' ' 81' ' ' VAL . . . -128.58 157.48 41.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.578 179.766 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . 0.783 HD11 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -148.57 132.02 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 0.0 111.831 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' LEU . . . . . 0.885 HD22 HG13 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -125.19 101.32 6.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.257 179.332 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' LEU . . . . . 0.773 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 3.6 mp -101.1 133.73 45.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.12 -179.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' PHE . . . . . 0.685 ' CE1' ' HB2' ' B' ' 55' ' ' HIS . 3.2 p90 -172.68 122.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.421 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' LYS . . . . . 0.824 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -104.75 168.34 9.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.658 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' SER . . . . . 0.739 ' HG ' ' HG3' ' B' ' 69' ' ' GLU . 4.3 m -122.15 19.45 10.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.319 0.58 . . . . 0.0 110.815 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.437 -1.202 . . . . 0.0 112.546 -179.968 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.755 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 17.6 tptp . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.942 0.401 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.05 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -110.23 -172.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.954 0.407 . . . . 0.0 111.263 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.502 ' N ' ' O ' ' A' ' 77' ' ' TYR . 95.6 t -140.04 77.35 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.747 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.804 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -42.85 149.86 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.064 0.459 . . . . 0.0 110.839 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.505 ' HE3' ' HB2' ' A' ' 77' ' ' TYR . 2.4 mmtt -137.71 -13.85 1.46 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.329 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -176.32 112.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.45 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.766 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -131.71 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 0.0 111.682 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.71 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -137.87 25.86 2.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.694 179.326 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.811 ' SD ' ' HE2' ' A' ' 17' ' ' MET . 25.7 ttp -117.08 166.44 12.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.723 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.988 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 74.4 m -51.92 135.93 29.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.715 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.723 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -41.81 -77.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.742 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.635 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.7 OUTLIER -45.95 -19.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.474 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.988 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.16 -42.22 26.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.45 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.861 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -69.27 -28.37 66.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.492 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.692 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 11.8 pt20 -75.78 -45.79 34.26 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.692 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 2.1 m-20 -67.11 -30.82 70.95 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.76 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.852 ' OG ' HD22 ' A' ' 85' ' ' LEU . 29.0 t -65.08 -47.61 76.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.922 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.811 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 56.4 t -57.85 -48.09 84.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.799 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.619 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 52.3 mt-10 -60.74 -38.3 84.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.353 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.625 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 57.1 m -66.41 -34.08 77.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.193 0.521 . . . . 0.0 109.668 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.898 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -70.21 -39.9 74.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.589 ' HA ' HD12 ' A' ' 29' ' ' LEU . 55.2 m -66.09 -38.88 89.35 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.958 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.594 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 7.6 mm-40 -58.19 -41.59 84.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.806 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.882 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -70.97 -29.14 65.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.794 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.898 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.0 OUTLIER -72.05 -41.92 66.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.026 179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.21 -36.55 77.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.184 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.523 ' HD3' ' CE1' ' A' ' 41' ' ' HIS . 2.1 mttp -79.73 -25.72 41.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.738 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.581 ' CE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.43 143.34 18.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -108.61 30.3 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.901 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.929 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 8.0 mm -110.53 111.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.849 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.741 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 8.5 mp0 -28.47 -82.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.823 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.547 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -37.19 -48.62 0.86 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.551 179.519 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.929 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.6 t70 -53.09 -63.53 1.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.804 ' HB ' HG11 ' A' ' 58' ' ' VAL . 5.3 mt -46.32 -47.06 6.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.805 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 1.026 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -56.53 -50.71 71.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.001 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.811 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -57.59 -55.46 34.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.775 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.882 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 1.2 t60 -47.1 -46.92 23.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.564 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.805 HG21 HD11 ' A' ' 85' ' ' LEU . 49.6 mt -61.1 -71.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.793 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 1.1 tmtt? -42.64 -40.56 2.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.151 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.467 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 24.3 tptt -55.57 -62.28 1.79 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.171 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.65 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp0 -62.76 -49.83 73.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.794 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -55.18 -35.67 65.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.26 -179.687 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.793 ' HB2' ' HE2' ' A' ' 43' ' ' LYS . 0.8 OUTLIER -72.02 -38.06 69.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.108 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.08 9.23 43.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.106 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.65 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -128.92 5.17 5.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.164 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.779 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 63.9 m-85 -144.61 -66.75 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.035 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.779 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 5.6 p30 162.57 109.18 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.187 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.7 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 77.0 Cg_exo -47.77 149.44 5.18 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 122.432 2.088 . . . . 0.0 112.477 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.799 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 11.0 t -119.51 135.82 54.61 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.056 0.542 . . . . 0.0 110.657 -0.214 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.716 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 47.4 m95 -96.67 124.61 40.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 111.741 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.791 ' CE1' HG23 ' A' ' 53' ' ' THR . 0.0 OUTLIER -107.94 101.98 11.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.726 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.999 ' HB2' HD12 ' A' ' 85' ' ' LEU . 1.9 p -116.86 152.17 35.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.265 0.555 . . . . 0.0 112.425 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.055 HG21 HG21 ' B' ' 57' ' ' ILE . 20.8 mm -130.36 110.96 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.379 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.026 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.4 p -105.18 121.23 56.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.38 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.696 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -162.42 176.35 38.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.144 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.694 ' HB3' ' HA ' ' A' ' 81' ' ' VAL . 0.1 OUTLIER -138.07 40.97 2.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.651 0.262 . . . . 0.0 111.297 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.712 ' O ' ' HG2' ' B' ' 60' ' ' ARG . 2.5 t-20 168.61 25.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.885 0.374 . . . . 0.0 111.208 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.932 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 15.1 p90 -109.34 -166.95 1.15 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.609 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.851 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -150.71 102.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.047 -0.597 . . . . 0.0 111.97 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.956 ' CB ' HD12 ' B' ' 57' ' ' ILE . 88.4 p -86.11 134.57 33.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.096 0.474 . . . . 0.0 111.584 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.829 ' HB3' ' HB1' ' B' ' 39' ' ' ALA . 60.1 t80 -149.83 87.49 1.49 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.057 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.871 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 11.5 m -132.66 168.1 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.216 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.928 HG21 ' CG2' ' B' ' 53' ' ' THR . 13.2 t -92.14 83.23 5.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.571 ' C ' ' HG2' ' A' ' 69' ' ' GLU . 32.2 p-80 -55.68 -179.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.49 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HG2' ' C ' ' A' ' 68' ' ' HIS . 0.7 OUTLIER 176.38 -166.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.918 0.39 . . . . 0.0 111.228 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.49 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 58.86 -100.23 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.836 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.49 ' H ' ' HB ' ' A' ' 70' ' ' THR . 1.3 mtmp? 179.15 28.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.991 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.79 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 3.7 m-70 -138.27 54.12 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.348 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.828 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.1 t80 -125.04 89.93 3.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.186 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.861 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.2 tt -109.55 142.44 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 111.673 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.63 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 21.6 t80 -130.96 131.55 44.49 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.063 179.034 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.811 ' CE2' ' HA ' ' A' ' 22' ' ' VAL . 1.2 p90 -154.85 179.27 9.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.152 -179.408 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.751 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 24.4 t80 -137.91 104.15 5.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.698 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.05 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.3 mm? -58.86 173.74 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.083 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.456 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.15 -44.59 0.17 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.039 -0.6 . . . . 0.0 112.872 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.661 ' O ' ' HG3' ' A' ' 80' ' ' GLN . 66.0 tp60 -144.8 25.58 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.609 0.242 . . . . 0.0 111.323 -179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.829 HG12 ' H ' ' A' ' 82' ' ' ALA . 13.9 t -146.79 178.04 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.841 0.353 . . . . 0.0 111.111 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.847 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -141.11 154.07 45.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.842 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.847 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -139.26 137.26 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.154 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.001 HD23 HG12 ' A' ' 57' ' ' ILE . 3.0 tp -121.89 81.81 1.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.573 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.999 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -85.87 126.66 34.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.329 -179.616 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.828 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -168.7 125.0 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.497 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.799 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -98.59 -171.27 2.09 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.631 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.457 ' OG ' ' HB3' ' B' ' 88' ' ' SER . 0.5 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-O 121.238 0.542 . . . . 0.0 110.641 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.668 ' HD2' ' HA ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.744 0.307 . . . . 0.0 111.129 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.59 ' C ' HD13 ' B' ' 78' ' ' LEU . 5.9 tppt? -93.51 47.21 1.23 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.091 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.019 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.32 -175.5 3.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.301 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' B' ' 77' ' ' TYR . 69.3 t -141.2 74.03 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.774 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.973 HD11 HD11 ' B' ' 74' ' ' ILE . 1.1 mp -34.1 157.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.074 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.752 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 6.1 mmpt? -146.4 -15.08 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.936 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.441 ' O ' ' N ' ' B' ' 75' ' ' TYR . 2.2 m-20 179.81 102.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.486 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.749 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -130.52 104.54 7.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.899 0.381 . . . . 0.0 111.935 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.604 ' N ' ' O ' ' B' ' 73' ' ' PHE . 4.4 t70 -89.21 30.6 0.95 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.154 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.914 ' SD ' ' HE2' ' B' ' 17' ' ' MET . 28.4 ttp -120.96 156.06 32.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.909 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.76 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.8 OUTLIER -46.98 135.78 9.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.59 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.762 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 10.6 mm-40 -41.36 -69.7 0.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.226 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 18.0 mm-40 -44.99 -37.97 4.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.891 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.914 ' HE2' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -65.64 -33.23 75.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.61 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.886 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.37 -29.48 63.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.103 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.668 ' HA ' ' HD2' ' B' ' 4' ' ' ARG . 6.7 pt20 -75.9 -41.74 51.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 0.0 110.382 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.41 -28.83 62.21 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.887 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.917 ' OG ' HD22 ' B' ' 85' ' ' LEU . 1.8 t -67.6 -44.27 78.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.184 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.882 HG23 ' O ' ' B' ' 18' ' ' GLN . 47.2 t -63.26 -48.51 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.766 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 85.8 mt-10 -55.06 -41.5 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.562 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 75.5 m -64.39 -37.76 88.64 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.368 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.769 ' HB1' HD12 ' B' ' 83' ' ' ILE . . . -67.9 -28.22 67.32 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.645 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 3.0 m -71.67 -43.22 66.4 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.77 178.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 6.7 mt-30 -53.13 -46.62 68.86 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.619 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.717 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -77.22 -20.26 55.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.291 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 1.072 HD21 HG11 ' B' ' 81' ' ' VAL . 6.3 mt -77.19 -32.96 56.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.11 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -89.42 -27.45 20.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.371 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.752 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 41.9 mmtm -83.47 -29.32 28.11 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.917 0.389 . . . . 0.0 110.705 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.752 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -152.68 141.09 20.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.566 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.71 29.39 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.955 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 1.031 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 7.5 mm -103.61 101.28 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.868 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.851 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.9 mp0 -29.83 -68.85 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.629 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -49.48 -56.2 10.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.818 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 1.031 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -49.27 -63.67 1.04 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.679 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.748 ' O ' HG13 ' B' ' 42' ' ' ILE . 38.8 mt -42.38 -46.31 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.935 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.949 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -63.65 -40.64 97.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.925 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.709 ' HA ' ' CE1' ' A' ' 65' ' ' TYR . . . -57.67 -67.15 0.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.967 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.689 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -46.66 -57.31 4.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.728 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.748 HG13 ' O ' ' B' ' 38' ' ' ILE . 78.1 mt -43.59 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.651 ' HB3' ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -36.99 -48.09 0.75 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.325 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.462 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -59.38 -45.3 91.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.549 -179.601 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.683 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.7 OUTLIER -69.68 -46.9 65.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.359 -179.519 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.825 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -60.85 -33.0 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.979 -179.823 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.781 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.73 -50.2 26.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.721 179.789 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.937 ' HE3' ' HA ' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -72.28 -22.36 61.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.683 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -90.45 -26.57 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.703 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 15.2 m-85 -120.02 -65.35 1.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.192 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.703 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 21.7 t-20 160.27 110.19 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.96 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.781 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 81.2 Cg_exo -43.84 149.79 0.68 Allowed 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 122.49 2.127 . . . . 0.0 112.717 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.928 ' CG2' HG21 ' A' ' 67' ' ' THR . 0.2 OUTLIER -125.75 137.92 53.83 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 122.955 0.502 . . . . 0.0 110.549 -0.104 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.772 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 34.2 m95 -95.28 121.5 37.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.828 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.871 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -91.09 97.91 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.437 178.672 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 1.021 ' HB3' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -113.72 143.44 44.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 112.448 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 1.055 HG21 HG21 ' A' ' 57' ' ' ILE . 21.2 mm -130.11 97.21 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.06 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 0.949 HG12 ' HB2' ' B' ' 39' ' ' ALA . 3.3 p -98.48 129.69 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.971 0.415 . . . . 0.0 111.385 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.733 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.96 -144.03 4.09 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.712 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.63 10.71 0.06 Allowed 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.756 0.312 . . . . 0.0 111.111 -179.659 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.519 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 62.2 t30 175.98 30.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.933 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.932 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 9.5 p90 -102.13 -166.64 1.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.985 0.422 . . . . 0.0 110.976 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.741 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -147.82 86.76 0.16 Allowed Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.919 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.975 ' CB ' HD12 ' A' ' 57' ' ' ILE . 8.3 p -73.28 141.64 47.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.398 . . . . 0.0 111.533 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.837 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 12.1 t80 -147.08 62.34 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.359 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.981 HG13 HD11 ' A' ' 57' ' ' ILE . 21.5 m -102.38 161.31 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' B' ' 69' ' ' GLU . 18.4 m -99.13 94.5 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.846 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.728 ' HA ' ' HD2' ' B' ' 86' ' ' PHE . 0.0 OUTLIER -31.22 -44.48 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.163 -179.853 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' B' ' 68' ' ' HIS . 19.3 pt-20 43.64 36.83 1.33 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.997 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.642 HG22 ' H ' ' B' ' 71' ' ' LYS . 3.0 m -170.16 -136.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.969 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.654 ' O ' ' HA ' ' B' ' 13' ' ' MET . 10.2 mtmm -146.43 12.47 1.19 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.71 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.852 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 8.4 m-70 -119.41 47.59 1.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.678 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.779 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 6.8 t80 -116.47 116.78 28.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.53 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.973 HD11 HD11 ' B' ' 8' ' ' ILE . 0.8 OUTLIER -135.85 125.76 41.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.999 0.428 . . . . 0.0 111.729 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.752 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 16.6 t80 -112.07 136.64 51.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.803 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.949 ' HE1' HG23 ' B' ' 74' ' ' ILE . 2.3 p90 -162.56 164.1 26.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 111.246 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.518 ' O ' ' N ' ' B' ' 7' ' ' VAL . 65.4 t80 -122.52 109.62 14.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.015 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.019 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -70.27 170.37 11.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.629 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.13 -47.03 0.02 OUTLIER Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.191 -0.528 . . . . 0.0 112.932 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.458 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 18.4 mt-30 -149.56 37.18 0.74 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.905 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 1.072 HG11 HD21 ' B' ' 29' ' ' LEU . 85.6 t -154.02 170.84 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.162 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.726 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -137.43 141.72 41.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.866 HD11 HD11 ' B' ' 29' ' ' LEU . 0.2 OUTLIER -128.24 128.6 68.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.07 0.462 . . . . 0.0 111.678 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.899 HD23 ' CG1' ' B' ' 57' ' ' ILE . 1.2 tp -116.31 85.3 2.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.031 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 1.021 HD12 ' HB3' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -93.03 128.94 39.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.573 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.728 ' HD2' ' HA ' ' B' ' 68' ' ' HIS . 1.2 p90 -167.62 123.7 1.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.849 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.772 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 32.7 mtpt -91.59 159.88 15.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.753 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.662 ' H ' ' CE1' ' B' ' 55' ' ' HIS . 32.2 m -105.17 18.31 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.302 0.572 . . . . 0.0 110.799 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.428 -1.207 . . . . 0.0 112.544 -179.962 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.638 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 20.7 tptm . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.828 0.347 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.086 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -135.9 -168.95 2.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.79 ' O ' ' HD2' ' A' ' 9' ' ' LYS . 73.6 t -145.67 72.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.932 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 1.065 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -43.92 162.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.251 0.548 . . . . 0.0 111.09 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.79 ' HD2' ' O ' ' A' ' 7' ' ' VAL . 0.0 OUTLIER -149.82 -22.42 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.343 179.095 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.663 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 54.8 t30 -156.5 165.52 36.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.265 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.666 ' HA ' ' CD1' ' A' ' 73' ' ' PHE . . . 166.54 127.97 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.985 0.422 . . . . 0.0 111.911 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.781 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 2.1 m-20 -118.36 26.93 9.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.872 178.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.899 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 28.6 ttp -108.91 167.04 10.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.823 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.69 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.1 OUTLIER -58.14 129.4 41.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.79 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.701 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 mt-10 -33.74 -66.72 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -50.55 -32.92 19.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.785 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.704 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 39.5 mmm -72.63 -33.72 66.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.17 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.895 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.49 -39.41 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.636 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.641 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 12.4 mt-30 -74.48 -34.3 63.08 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.289 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.24 -31.79 66.13 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.848 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.751 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -67.34 -46.45 73.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.18 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.934 HG13 ' CE2' ' A' ' 76' ' ' PHE . 11.8 t -59.67 -45.16 94.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.541 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 43.0 mt-10 -59.64 -37.0 77.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.117 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.646 ' SG ' HG23 ' A' ' 42' ' ' ILE . 11.5 t -66.32 -40.22 89.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.159 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.74 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -67.49 -22.59 65.45 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.688 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 2.3 m -78.85 -46.39 18.72 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.581 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.57 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 7.4 mm100 -48.06 -45.23 32.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.417 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.748 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -77.47 -33.84 54.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.127 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.698 ' CD1' ' HG ' ' A' ' 78' ' ' LEU . 5.5 mt -63.75 -24.02 67.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.055 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -99.43 -28.65 13.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.554 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.805 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 29.5 mmtp -84.87 -27.27 26.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 111.091 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.805 ' CE1' ' HB2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -146.25 161.31 40.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -126.31 36.38 4.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.952 HG22 ' HD3' ' A' ' 36' ' ' LYS . 3.3 mm -120.15 97.43 5.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.829 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.673 ' C ' ' HA3' ' B' ' 63' ' ' GLY . 2.5 mp0 -22.5 -72.71 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.206 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.952 ' HD3' HG22 ' A' ' 34' ' ' ILE . 0.0 OUTLIER -47.62 -51.04 22.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.5 179.617 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.893 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.6 t0 -54.38 -62.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.52 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.754 ' O ' HG13 ' A' ' 42' ' ' ILE . 5.6 mt -43.51 -42.82 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.874 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 1.061 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -65.6 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.902 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.821 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -39.1 -51.39 1.88 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.938 0.399 . . . . 0.0 110.724 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.548 ' CE1' ' CD1' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -64.91 -54.91 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.89 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.762 ' CG2' HD11 ' A' ' 85' ' ' LEU . 83.9 mt -45.72 -56.42 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.098 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.502 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -59.47 -70.9 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.966 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.546 ' C ' ' HD2' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -34.1 -59.97 0.41 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.959 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -46.76 84.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.941 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.751 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -59.76 -18.58 44.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.817 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.715 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -87.84 -34.27 18.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.636 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -99.56 6.72 45.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.755 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.97 6.68 8.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.102 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.56 ' CD1' ' HE1' ' A' ' 17' ' ' MET . 95.2 m-85 -149.1 -67.3 0.22 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.738 ' O ' ' HE2' ' A' ' 87' ' ' LYS . 12.3 m-20 160.93 108.52 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.432 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.715 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 92.0 Cg_exo -43.85 155.76 0.19 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.47 2.113 . . . . 0.0 112.437 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.816 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.5 m -117.2 132.61 56.6 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 123.199 0.6 . . . . 0.0 110.485 -0.048 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.841 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 60.6 m95 -98.81 166.89 11.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.415 0.626 . . . . 0.0 111.951 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.88 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.0 OUTLIER -158.03 109.26 2.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.237 179.269 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.807 ' CB ' HD12 ' A' ' 85' ' ' LEU . 6.2 p -121.96 152.05 40.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.223 0.535 . . . . 0.0 112.425 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.013 HD11 HG13 ' B' ' 66' ' ' VAL . 20.9 mm -129.13 105.93 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.391 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.061 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.6 p -104.13 124.33 58.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.915 0.388 . . . . 0.0 111.675 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.879 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -149.65 -131.45 1.94 Allowed Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.758 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.628 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -160.02 5.64 0.09 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.657 0.265 . . . . 0.0 111.475 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.628 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 41.8 t30 166.7 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.763 0.315 . . . . 0.0 111.312 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.748 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 45.9 p90 -77.5 -178.33 5.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.0 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.62 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.94 76.94 0.39 Allowed Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.177 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.945 ' HA ' HG23 ' B' ' 57' ' ' ILE . 88.6 p -69.98 151.97 44.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.881 0.372 . . . . 0.0 111.354 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.801 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 11.6 t80 -164.22 56.81 0.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.589 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.756 HG11 ' CZ ' ' A' ' 86' ' ' PHE . 6.9 m -80.83 -161.12 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.049 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.781 HG21 ' OG1' ' B' ' 53' ' ' THR . 1.2 m -157.03 96.47 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.221 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.707 ' CD2' ' HA ' ' A' ' 88' ' ' SER . 36.4 t-80 -175.68 -97.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.846 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.636 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 0.6 OUTLIER 43.75 75.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.973 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -101.99 -37.27 8.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.984 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.781 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 4.3 ptpt -177.67 12.18 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.941 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.932 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 61.6 m-70 -136.97 23.99 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.822 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.849 ' HD2' ' HB3' ' A' ' 86' ' ' PHE . 14.1 t80 -105.63 168.8 8.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.852 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.895 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.4 tt 171.54 119.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.124 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.426 ' O ' ' HD3' ' A' ' 9' ' ' LYS . 3.5 t80 -116.52 111.33 19.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.809 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 1.065 ' HB3' HG13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -130.98 176.46 8.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.221 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.732 ' CB ' ' HE2' ' A' ' 9' ' ' LYS . 20.2 t80 -135.93 103.97 5.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.756 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.086 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -61.41 177.66 0.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.916 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.83 -42.03 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.46 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.528 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 2.2 pm0 -154.53 43.04 0.5 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.862 0.363 . . . . 0.0 110.829 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.879 HG13 ' O ' ' A' ' 59' ' ' GLY . 55.6 t -154.49 166.85 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.116 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.63 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -134.68 114.48 12.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.673 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.719 HG21 ' HB2' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -105.71 120.4 56.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.998 0.428 . . . . 0.0 111.429 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.0 HD23 HG12 ' A' ' 57' ' ' ILE . 0.3 OUTLIER -105.06 91.78 3.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.316 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.807 HD12 ' CB ' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -95.86 127.11 41.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -179.282 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.849 ' HB3' ' HD2' ' A' ' 73' ' ' PHE . 30.0 p90 -158.06 144.48 17.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.742 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.932 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -105.14 -170.23 1.72 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.957 0.408 . . . . 0.0 110.771 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.88 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 121.471 0.653 . . . . 0.0 109.994 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.772 ' HG2' ' CD ' ' B' ' 19' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.877 0.37 . . . . 0.0 110.815 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.676 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.0 OUTLIER -80.44 118.67 22.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.039 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 162.1 -167.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.116 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.675 ' O ' ' HG2' ' B' ' 9' ' ' LYS . 22.7 t -156.67 73.24 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.954 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -47.24 148.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.06 0.457 . . . . 0.0 110.535 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.755 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 2.8 mmtt -154.68 -1.95 0.17 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.324 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.906 ' HB3' ' HB3' ' B' ' 75' ' ' TYR . 20.2 t-20 -164.08 70.3 0.2 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.963 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.764 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -110.73 153.81 24.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.133 0.492 . . . . 0.0 111.511 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.528 ' N ' ' O ' ' B' ' 73' ' ' PHE . 6.9 t70 -149.85 28.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.015 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.925 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 11.9 ttp -121.48 170.82 9.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.66 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.723 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.3 OUTLIER -57.19 140.86 48.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.716 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.713 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 31.5 mp0 -46.0 -63.39 0.99 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.172 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -28.69 19.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.004 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.925 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 53.4 mmm -79.63 -35.56 39.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.048 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.738 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -71.17 -35.67 71.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.921 0.391 . . . . 0.0 110.315 179.657 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.772 ' CD ' ' HG2' ' B' ' 4' ' ' ARG . 12.7 mm100 -75.16 -36.56 61.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.182 0.515 . . . . 0.0 109.646 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.552 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 5.4 m-20 -70.35 -29.28 65.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.653 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.844 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -68.92 -49.22 59.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.905 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.819 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 77.6 t -54.28 -45.29 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.139 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 83.6 mt-10 -58.94 -39.6 82.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.878 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' B' ' 42' ' ' ILE . 13.3 t -65.22 -36.23 83.52 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.009 -0.542 . . . . 0.0 109.968 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.776 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -69.26 -29.56 67.49 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.536 ' HA ' HD12 ' B' ' 29' ' ' LEU . 2.0 m -71.45 -37.69 71.36 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.825 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' B' ' 31' ' ' LYS . 43.1 mt-30 -60.72 -42.73 97.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.692 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.939 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -73.42 -27.2 61.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.583 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.776 HD12 ' O ' ' B' ' 25' ' ' ALA . 2.5 mt -72.98 -49.19 30.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.87 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.75 -26.64 63.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.024 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.646 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 2.6 mttp -86.73 -30.32 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.966 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.63 ' HE1' ' ND1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.6 163.91 36.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.005 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -126.42 27.75 6.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.75 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.695 ' HB ' ' CB ' ' B' ' 37' ' ' ASP . 9.2 mm -108.78 106.39 20.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.797 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.629 ' OE2' ' HA2' ' B' ' 59' ' ' GLY . 2.0 mm-40 -29.78 -71.03 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.452 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -46.82 -48.05 20.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.869 0.366 . . . . 0.0 110.609 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.695 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 14.3 t0 -54.77 -60.81 2.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.648 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.939 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 3.9 mt -48.13 -49.1 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.516 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 1.067 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -56.6 -35.5 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.43 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.801 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -72.04 -63.64 1.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.317 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.741 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -37.47 -56.13 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.14 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.787 HD11 HG22 ' B' ' 38' ' ' ILE . 6.9 mt -56.56 -68.24 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.284 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.644 ' HE3' ' HE2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -38.94 -47.84 1.5 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.827 0.346 . . . . 0.0 111.146 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' B' ' 43' ' ' LYS . 0.4 OUTLIER -61.91 -53.11 60.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.462 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.535 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 1.2 tp10 -60.83 -34.21 74.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.164 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.844 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -67.06 -49.04 66.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.821 0.343 . . . . 0.0 110.606 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.674 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -55.73 -37.66 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.86 -20.2 22.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.383 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 3.0 tttt -88.5 -13.35 40.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 111.18 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.651 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 23.3 m-85 -142.49 -67.54 0.37 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.418 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.651 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 30.8 t-20 160.22 117.32 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.827 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.674 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 10.7 Cg_endo -53.28 168.96 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.442 2.095 . . . . 0.0 112.511 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.781 ' OG1' HG21 ' A' ' 67' ' ' THR . 8.6 t -109.99 122.45 47.61 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 122.833 0.453 . . . . 0.0 110.775 0.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.853 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 48.5 m95 -92.44 120.8 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.704 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.734 ' NE2' HG23 ' B' ' 53' ' ' THR . 0.2 OUTLIER -100.0 105.44 17.11 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.116 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.992 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -130.8 165.28 23.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.52 0.676 . . . . 0.0 112.183 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.988 HD12 HG13 ' A' ' 57' ' ' ILE . 34.3 mt -146.44 165.41 8.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.589 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.067 HG12 ' HB2' ' B' ' 39' ' ' ALA . 1.7 p -155.14 122.35 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 111.596 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.629 ' HA2' ' OE2' ' B' ' 35' ' ' GLU . . . -149.2 -175.02 21.23 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.037 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.646 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.9 OUTLIER -146.3 36.18 1.0 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.218 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.646 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.2 OUTLIER 168.11 26.6 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.121 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.8 ' CE2' ' HB3' ' B' ' 64' ' ' SER . 0.1 OUTLIER -111.48 -166.57 1.09 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.674 ' HA3' ' N ' ' A' ' 36' ' ' LYS . . . -144.8 77.79 0.27 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.843 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 64' ' ' SER . . . . . 1.006 ' HB2' HD12 ' A' ' 57' ' ' ILE . 18.1 p -70.6 131.77 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.034 0.445 . . . . 0.0 111.531 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.821 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 55.7 t80 -144.76 76.51 1.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.304 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 1.013 HG13 HD11 ' A' ' 57' ' ' ILE . 28.5 m -110.2 167.39 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.235 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.594 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 28.7 m -112.8 134.98 54.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.875 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.541 ' HB3' ' CG ' ' B' ' 73' ' ' PHE . 0.7 OUTLIER -87.36 176.63 7.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.834 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.631 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -162.61 56.81 0.22 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.827 -179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.697 HG23 ' H ' ' B' ' 71' ' ' LYS . 2.0 t 169.37 -108.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.947 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.697 ' H ' HG23 ' B' ' 70' ' ' THR . 0.0 OUTLIER -163.26 28.94 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.606 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.965 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 7.3 m80 -128.75 41.96 3.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.983 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 12.9 t80 -117.59 83.65 2.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.357 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.877 HD11 HD11 ' B' ' 8' ' ' ILE . 0.0 OUTLIER -110.94 109.5 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.922 -179.155 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.906 ' HB3' ' HB3' ' B' ' 10' ' ' ASN . 14.1 t80 -99.33 126.02 45.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.315 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.954 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.7 p90 -142.92 170.24 16.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.007 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.659 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 50.9 t80 -132.9 116.94 17.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.621 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.039 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -69.13 167.64 15.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.679 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -29.12 -46.9 0.08 OUTLIER Glycine 0 C--N 1.329 0.145 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.945 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -143.32 27.63 1.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.684 HG12 ' N ' ' B' ' 82' ' ' ALA . 38.3 t -145.41 171.03 5.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.894 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.844 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -132.34 145.52 51.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.882 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.844 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -142.97 106.42 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.153 -179.741 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.787 HD23 ' HB ' ' B' ' 57' ' ' ILE . 0.2 OUTLIER -97.97 110.17 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.575 179.741 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.992 HD12 ' HB2' ' B' ' 56' ' ' CYS . 2.0 mp -106.88 125.21 50.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.9 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.723 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.7 OUTLIER -151.58 119.07 6.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.364 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.965 ' HB2' ' HB2' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -97.01 164.27 12.59 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.758 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.631 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -119.23 18.98 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.341 0.591 . . . . 0.0 110.649 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 89' ' ' GLY . . . . . 0.482 ' HA2' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.339 -1.256 . . . . 0.0 112.467 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.787 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.617 0.246 . . . . 0.0 110.75 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.049 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 159.15 172.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.693 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.777 ' O ' ' HE2' ' A' ' 9' ' ' LYS . 8.7 t -131.03 69.37 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.924 HD11 HD11 ' A' ' 74' ' ' ILE . 0.9 OUTLIER -33.48 149.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.777 ' HE2' ' O ' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -134.84 -12.71 2.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.8 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 177.51 93.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.638 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.78 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -129.72 104.13 7.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.723 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.54 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 16.8 m-20 -96.01 27.71 3.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.234 0.54 . . . . 0.0 109.866 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.919 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.9 OUTLIER -103.79 168.96 8.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.783 -179.622 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.902 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -51.32 123.59 9.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.466 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -34.86 -69.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.824 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.525 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 32.6 tt0 -52.15 -28.38 17.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.919 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -71.85 -41.6 67.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.856 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.738 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.42 -29.51 69.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.944 0.402 . . . . 0.0 110.331 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.759 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -77.21 -42.32 37.87 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.097 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.759 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -69.29 -28.4 66.25 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.555 178.986 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.887 ' OG ' HD22 ' A' ' 85' ' ' LEU . 30.0 t -67.11 -51.12 58.07 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.969 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.777 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 94.1 t -54.41 -46.59 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.926 179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -54.34 -43.62 71.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.351 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -39.27 91.76 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.951 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.731 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -69.39 -30.97 69.07 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -70.68 -37.08 73.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.58 178.499 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -58.81 -42.4 89.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.928 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -79.84 -23.03 42.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.289 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.731 HD12 ' O ' ' A' ' 25' ' ' ALA . 4.6 mt -81.1 -26.13 36.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.022 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.23 -32.47 15.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.201 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -86.08 -24.94 26.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.783 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.628 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -150.11 155.86 40.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.614 179.893 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.413 ' HA ' HD11 ' A' ' 38' ' ' ILE . 0.0 OUTLIER -123.54 28.53 6.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.063 0.458 . . . . 0.0 110.735 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.88 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 16.1 mm -106.59 107.54 22.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.942 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.774 ' HB3' ' CA ' ' B' ' 63' ' ' GLY . 0.9 OUTLIER -26.67 -84.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.033 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.01 -47.31 2.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.323 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.88 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -54.75 -63.11 1.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 0.0 111.14 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.928 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 3.2 mt -48.2 -48.21 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.937 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.86 -42.1 92.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.05 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.797 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.4 -64.67 0.77 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.077 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.685 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -52.29 -39.53 60.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.659 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.778 ' CG2' HD11 ' A' ' 85' ' ' LEU . 85.4 mt -58.56 -57.22 11.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.958 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.525 ' HZ2' ' HE2' ' B' ' 65' ' ' TYR . 0.2 OUTLIER -51.57 -60.51 3.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -42.57 -62.23 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.602 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.3 mt-10 -42.98 -67.48 0.27 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.946 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.813 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -44.57 -51.32 9.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.723 ' OD1' ' HB2' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -57.54 -25.02 59.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.087 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -120.97 14.27 11.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.18 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.5 tttp -128.44 1.89 5.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.389 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 72.2 m-85 -152.85 -62.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.185 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.482 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 3.1 m-20 161.24 117.67 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.566 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.583 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 19.1 Cg_endo -60.06 169.18 5.07 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.521 2.147 . . . . 0.0 112.327 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.784 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 88.6 m -104.92 130.58 53.06 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.011 0.525 . . . . 0.0 110.254 -0.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.723 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 69.1 m95 -101.51 170.56 8.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.654 0.74 . . . . 0.0 112.421 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.624 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.3 OUTLIER -162.92 103.64 1.01 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.442 179.495 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.965 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -117.97 156.12 29.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.538 0.685 . . . . 0.0 112.796 -177.667 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.951 ' CG1' HD23 ' A' ' 84' ' ' LEU . 27.0 mm -127.45 157.52 39.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.144 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.937 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.1 p -152.36 112.12 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.888 0.375 . . . . 0.0 111.276 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.502 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -150.75 -155.86 7.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.157 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.49 HH11 ' HB2' ' A' ' 60' ' ' ARG . 0.1 OUTLIER -163.5 34.72 0.09 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 120.76 0.314 . . . . 0.0 111.289 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 2.6 t-20 171.05 26.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.787 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 24.0 p90 -111.12 179.95 3.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.802 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.873 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -135.4 96.29 0.27 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.321 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.905 ' CA ' HD12 ' B' ' 57' ' ' ILE . 4.7 p -82.03 129.82 34.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.061 0.458 . . . . 0.0 111.54 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.803 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 67.3 t80 -143.49 84.18 1.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.118 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.882 HG13 HD11 ' B' ' 57' ' ' ILE . 4.4 m -135.81 159.85 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.306 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.821 HG22 ' CE1' ' B' ' 55' ' ' HIS . 1.3 t -66.75 -171.98 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.034 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.814 ' CD2' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -129.05 172.69 11.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.011 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.738 ' CG ' ' HA ' ' A' ' 88' ' ' SER . 7.1 mm-40 -163.85 143.85 8.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.885 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.707 HG21 ' NZ ' ' A' ' 87' ' ' LYS . 48.3 m 47.64 -102.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.797 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 19.6 mmtt -74.06 32.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.742 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.752 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 53.7 m-70 48.77 -87.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.752 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 2.3 p90 163.51 156.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.786 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.924 HD11 HD11 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -127.96 106.21 14.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 111.024 179.566 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.743 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 63.4 t80 -106.72 93.82 4.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.856 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -107.69 168.59 9.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.331 -179.534 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.897 ' HD1' ' HB2' ' A' ' 82' ' ' ALA . 76.7 t80 -127.0 87.39 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.716 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.049 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -40.67 167.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.465 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.38 -48.58 0.33 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.759 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.25 20.6 2.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.743 HG12 ' N ' ' A' ' 82' ' ' ALA . 39.9 t -140.7 175.12 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.897 ' HB2' ' HD1' ' A' ' 77' ' ' TYR . . . -137.14 143.45 42.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.661 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.666 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 0.2 OUTLIER -132.45 111.49 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 -179.721 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.951 HD23 ' CG1' ' A' ' 57' ' ' ILE . 3.9 tp -94.93 88.81 5.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.417 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.965 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -93.65 141.0 28.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.458 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.699 ' HB3' ' HB2' ' A' ' 73' ' ' PHE . 2.8 p90 -176.51 152.23 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.797 ' HZ3' ' HG2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -112.43 -168.46 1.32 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.841 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.738 ' HA ' ' CG ' ' A' ' 69' ' ' GLU . 41.8 m . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.297 0.57 . . . . 0.0 110.517 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.444 ' HB2' ' NH1' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.781 0.324 . . . . 0.0 110.89 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.497 ' C ' HD13 ' B' ' 78' ' ' LEU . 0.8 OUTLIER 46.08 31.01 1.04 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.002 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.008 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.79 -177.94 4.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.27 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.904 HG12 ' HE2' ' B' ' 9' ' ' LYS . 72.9 t -141.85 68.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.553 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.884 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -38.58 150.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 -179.725 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.904 ' HE2' HG12 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -137.92 -15.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.991 179.497 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.5 OUTLIER -175.92 122.73 0.19 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.417 -179.864 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.623 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -149.03 102.08 3.22 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.788 0.328 . . . . 0.0 111.821 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.775 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -84.62 26.79 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.291 0.567 . . . . 0.0 109.857 178.893 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.876 ' HG2' ' N ' ' B' ' 14' ' ' SER . 0.1 OUTLIER -114.66 166.76 11.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.544 -179.586 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.876 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.3 OUTLIER -55.33 141.37 36.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.744 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.653 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -51.58 -56.59 12.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -28.73 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.686 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.751 ' HA ' ' OD2' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -75.56 -39.51 58.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.851 179.85 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.974 ' O ' HG23 ' B' ' 22' ' ' VAL . 0.0 OUTLIER -66.42 -29.25 69.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.052 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -77.55 -45.15 26.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.095 0.474 . . . . 0.0 109.818 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.751 ' OD2' ' HA ' ' B' ' 17' ' ' MET . 2.2 p30 -70.97 -27.72 63.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.741 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.787 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 96.2 p -68.88 -44.27 73.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.232 179.304 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.974 HG23 ' O ' ' B' ' 18' ' ' GLN . 40.6 t -62.67 -47.32 93.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.564 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -58.73 -35.05 72.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.69 -37.24 79.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.006 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.728 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -70.08 -31.14 68.57 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.7 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 23.8 m -71.0 -42.34 69.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.295 -1.321 . . . . 0.0 109.505 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.545 ' O ' ' HG3' ' B' ' 30' ' ' GLU . 1.7 mt-30 -51.97 -46.44 64.8 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.316 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.828 ' HB3' HG23 ' B' ' 38' ' ' ILE . . . -77.24 -19.83 56.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.172 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.837 HD11 HD11 ' B' ' 83' ' ' ILE . 5.2 mt -78.71 -25.22 44.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.938 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 30' ' ' GLU . . . . . 0.545 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 1.2 pt-20 -90.28 -38.39 13.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.172 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.858 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.2 mmtp -77.52 -33.48 54.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.614 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.858 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -143.4 146.38 33.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.812 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.506 ' OD1' HD13 ' B' ' 34' ' ' ILE . 26.2 p30 -113.52 30.22 7.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.925 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 14.6 mm -106.78 105.98 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.676 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.873 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.3 mp0 -29.52 -67.48 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.605 ' HD3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -52.71 -56.96 11.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.886 0.374 . . . . 0.0 110.719 179.625 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.925 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.7 t0 -45.55 -65.43 0.54 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.743 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.828 HG23 ' HB3' ' B' ' 28' ' ' ALA . 8.2 mt -43.76 -58.94 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.114 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 1.035 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -45.96 -52.83 11.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.952 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.803 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -47.84 -66.11 0.46 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.967 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.58 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -45.86 -43.64 13.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.942 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.728 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 67.1 mt -54.85 -62.84 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.79 ' HB3' ' CE2' ' A' ' 65' ' ' TYR . 12.0 tttm -50.48 -37.28 37.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.752 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' B' ' 48' ' ' LYS . 0.3 OUTLIER -64.2 -46.99 81.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.093 -179.811 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.726 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 26.3 tt0 -73.25 -28.83 62.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.787 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -77.49 -36.17 52.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.768 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 4.0 m-20 -74.92 -30.49 61.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.098 0.475 . . . . 0.0 110.221 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.427 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -87.08 -40.78 14.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.753 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.726 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.9 ttmt -76.6 -27.34 55.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 -179.553 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.556 ' CD2' ' HE1' ' B' ' 17' ' ' MET . 16.7 m-85 -121.02 -68.52 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.339 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.497 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER 155.86 119.47 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 -179.523 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.768 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 19.7 Cg_endo -58.53 168.31 4.16 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 122.375 2.05 . . . . 0.0 112.645 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.623 HG21 HG21 ' A' ' 67' ' ' THR . 15.1 t -106.91 133.16 51.99 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.229 0.244 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.89 ' NE1' ' HE3' ' B' ' 87' ' ' LYS . 39.5 m95 -103.86 110.14 22.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.418 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.821 ' CE1' HG22 ' A' ' 67' ' ' THR . 3.5 m170 -82.57 95.62 7.82 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.678 ' O ' HD13 ' B' ' 57' ' ' ILE . 24.5 p -110.43 133.93 52.81 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.019 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.949 ' CG1' HD23 ' B' ' 84' ' ' LEU . 17.6 mm -125.15 115.23 43.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.704 178.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.035 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -116.87 119.13 61.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.024 0.44 . . . . 0.0 111.691 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.805 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -137.17 -125.98 2.47 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.809 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 0.7 OUTLIER -165.15 -6.1 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.671 0.272 . . . . 0.0 111.464 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 14.2 t-20 179.26 37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.856 0.36 . . . . 0.0 111.077 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.787 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.4 p90 -88.62 179.85 6.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.774 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -125.28 74.98 0.4 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.981 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.866 ' HA ' HG23 ' A' ' 57' ' ' ILE . 65.4 p -71.26 135.26 47.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.965 0.412 . . . . 0.0 111.514 -179.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.877 ' H ' HD13 ' A' ' 57' ' ' ILE . 18.4 t80 -146.83 71.16 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.458 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.854 HG21 ' CD2' ' B' ' 86' ' ' PHE . 17.9 m -104.59 163.73 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.097 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.617 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 20.0 m -103.02 103.94 14.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.15 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.535 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.7 OUTLIER -70.74 -158.36 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.535 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.4 OUTLIER 177.33 -87.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.056 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.5 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 2.0 m -37.97 -99.2 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.281 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.599 ' HB3' ' NZ ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 179.16 44.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.903 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.698 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 36.6 m80 -135.48 42.52 2.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.877 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.775 ' HD1' ' H ' ' B' ' 12' ' ' ASP . 2.7 t80 -113.6 106.83 14.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.419 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.837 HG23 ' HE1' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -121.81 144.83 29.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.641 -179.797 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -133.95 133.35 41.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.006 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.884 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.08 163.55 36.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.577 -179.344 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.684 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 11.5 t80 -120.79 105.25 10.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.737 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.008 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.3 mm? -69.86 170.77 10.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.605 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.73 -35.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.898 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.599 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -159.54 43.41 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.787 0.327 . . . . 0.0 110.854 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.805 HG13 ' O ' ' B' ' 59' ' ' GLY . 54.2 t -158.92 167.1 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.235 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.614 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -140.8 101.14 4.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.707 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.837 HD11 HD11 ' B' ' 29' ' ' LEU . 0.3 OUTLIER -84.61 150.06 4.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.374 -179.64 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.949 HD23 ' CG1' ' B' ' 57' ' ' ILE . 1.6 tp -135.64 84.88 2.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.716 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -87.91 137.46 32.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 110.948 179.816 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.854 ' CD2' HG21 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -171.64 124.23 0.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.897 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.89 ' HE3' ' NE1' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -96.62 149.35 21.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.799 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -109.97 20.41 17.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.302 0.572 . . . . 0.0 110.566 179.809 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.429 -1.206 . . . . 0.0 112.508 -179.987 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.783 0.325 . . . . 0.0 111.378 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.097 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.18 -169.61 2.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.217 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 77' ' ' TYR . 15.1 t -147.89 72.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.87 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.806 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.9 135.82 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.029 0.442 . . . . 0.0 110.355 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' HG12 ' A' ' 7' ' ' VAL . 8.5 mmpt? -113.59 -18.59 11.89 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.544 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.64 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -176.06 158.62 2.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.682 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 169.03 138.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.998 0.427 . . . . 0.0 111.685 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.791 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER -123.65 28.96 6.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.464 179.461 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.728 ' HG3' ' H ' ' A' ' 14' ' ' SER . 15.8 ttp -104.44 170.44 7.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.842 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.728 ' H ' ' HG3' ' A' ' 13' ' ' MET . 22.7 t -56.41 129.35 40.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.699 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.667 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.0 mm-40 -36.72 -67.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -48.58 -29.51 4.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.802 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.652 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.54 -31.91 62.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.791 179.799 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.979 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -72.83 -39.07 66.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.586 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.609 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 93.0 mt-30 -77.46 -34.09 54.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.763 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.0 OUTLIER -71.49 -36.25 71.07 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.603 179.12 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.999 ' HB2' HD22 ' A' ' 85' ' ' LEU . 1.2 p -64.34 -50.15 68.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.942 179.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.954 HG23 ' O ' ' A' ' 18' ' ' GLN . 16.4 t -54.98 -45.15 76.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.338 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.673 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 11.8 mt-10 -56.07 -41.05 74.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.35 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.63 -39.44 93.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.141 0.496 . . . . 0.0 110.027 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.769 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.22 -30.89 69.15 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.543 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -70.75 -36.95 73.37 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.498 178.543 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 72.8 mt-30 -59.52 -41.62 90.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.478 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.927 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -83.04 -22.57 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.688 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.737 HD12 ' C ' ' A' ' 25' ' ' ALA . 4.3 mt -76.28 -36.13 58.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.992 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.08 -29.65 19.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.837 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.667 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 20.6 mttt -83.63 -20.84 32.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.74 ' CE1' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -146.31 -172.52 3.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.586 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.09 27.48 0.36 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.103 0.478 . . . . 0.0 110.542 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.064 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 18.9 mm -114.57 104.64 17.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.772 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 3.5 mp0 -25.39 -77.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.393 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.501 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -46.17 -45.14 16.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.193 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 1.064 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -57.97 -60.14 4.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.936 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.927 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 4.3 mt -51.75 -54.78 11.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.985 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 1.041 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -53.78 -39.38 65.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.043 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.754 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.9 -63.12 1.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.123 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.74 ' CD2' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -54.76 -49.03 71.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.822 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.822 ' CG2' HD11 ' A' ' 85' ' ' LEU . 73.3 mt -44.39 -58.85 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.091 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.736 ' HE3' ' CE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -60.26 -61.61 2.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.682 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.569 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 10.6 mttt -36.71 -66.31 0.23 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.004 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.751 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mm-40 -49.16 -42.6 40.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.91 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -61.9 -42.71 99.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.165 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.733 ' HA ' ' CD1' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -65.55 -24.11 67.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.845 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.92 8.92 16.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.461 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.751 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 7.4 tttm -118.17 -1.52 11.35 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.718 ' CE1' ' HB3' ' A' ' 49' ' ' LYS . 10.9 m-85 -150.52 -62.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.363 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.695 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 17.3 t-20 164.82 115.46 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.291 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.723 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 18.9 Cg_endo -60.03 168.82 5.45 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.339 2.026 . . . . 0.0 112.593 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.789 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.9 m -101.82 137.34 40.25 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 110.3 0.032 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.84 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 76.5 m95 -106.12 140.42 39.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.517 0.675 . . . . 0.0 112.039 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.883 ' HE2' ' HB2' ' A' ' 88' ' ' SER . 0.4 OUTLIER -132.18 107.82 8.86 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.923 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 1.027 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -127.87 175.08 8.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.388 0.614 . . . . 0.0 112.198 -177.922 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.922 HG12 ' HA ' ' B' ' 64' ' ' SER . 60.8 mt -155.39 165.1 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.713 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.041 HG12 ' HB2' ' A' ' 39' ' ' ALA . 7.5 p -151.55 119.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.942 0.401 . . . . 0.0 110.984 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.479 ' O ' ' N ' ' A' ' 82' ' ' ALA . . . -143.91 -174.49 16.22 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.113 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.802 HH11 ' HG3' ' A' ' 60' ' ' ARG . 0.4 OUTLIER -150.88 30.06 0.65 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.825 0.345 . . . . 0.0 111.014 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.544 ' OD1' ' NH1' ' B' ' 60' ' ' ARG . 0.4 OUTLIER 172.14 27.5 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.793 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -111.07 -168.21 1.27 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.738 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -142.13 78.59 0.28 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.855 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.807 ' HA ' HG23 ' B' ' 57' ' ' ILE . 5.8 p -72.23 128.54 35.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.992 0.425 . . . . 0.0 111.231 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.871 ' H ' HD13 ' B' ' 57' ' ' ILE . 33.0 t80 -143.45 83.59 1.78 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.415 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.014 HG13 HD11 ' B' ' 57' ' ' ILE . 2.9 m -127.42 155.85 38.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.453 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.825 HG22 ' NE2' ' B' ' 55' ' ' HIS . 1.2 t -63.75 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.488 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.804 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -148.02 112.76 5.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.847 0.356 . . . . 0.0 111.198 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.738 ' CB ' ' HA ' ' A' ' 88' ' ' SER . 38.9 mm-40 -97.43 174.08 6.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.747 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.547 ' C ' ' H ' ' A' ' 72' ' ' HIS . 0.2 OUTLIER 38.02 -119.19 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.688 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.43 ' H ' ' HB ' ' A' ' 70' ' ' THR . 3.1 mttt -71.16 30.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.904 0.383 . . . . 0.0 110.832 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.804 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 15.1 m80 68.91 -88.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.008 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.793 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 162.55 -163.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.752 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.979 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.2 OUTLIER -169.64 111.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.617 179.515 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.445 ' CE1' ' OG ' ' A' ' 64' ' ' SER . 40.0 t80 -105.38 129.21 53.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.309 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.806 ' HB3' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -141.77 178.73 7.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.203 -179.849 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.847 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 5.3 t80 -140.18 102.75 4.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.097 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -67.88 -176.0 0.62 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.922 0.391 . . . . 0.0 111.043 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.545 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -55.82 88.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.278 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.631 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.4 OUTLIER 80.07 10.64 1.23 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.777 0.322 . . . . 0.0 110.863 -179.841 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.838 HG12 ' H ' ' A' ' 82' ' ' ALA . 4.4 t -136.22 177.49 6.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.248 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.969 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -148.55 159.7 43.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.969 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.5 OUTLIER -146.21 117.23 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.915 0.388 . . . . 0.0 111.707 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.948 HD21 ' HE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -99.64 100.02 10.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.301 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 1.027 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.5 OUTLIER -103.2 130.98 50.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.948 ' HE2' HD21 ' A' ' 84' ' ' LEU . 34.3 p90 -166.89 131.79 2.08 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.773 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.84 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 34.6 mtpt -86.2 -163.2 0.85 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.837 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.883 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 2.8 m . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 121.372 0.606 . . . . 0.0 110.366 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.832 ' HD2' ' N ' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.826 0.346 . . . . 0.0 110.912 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.632 ' CE ' ' HA ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 42.61 28.06 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.599 -179.822 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.097 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.15 -164.71 1.35 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.932 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 77' ' ' TYR . 14.7 t -151.5 75.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.126 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.904 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -40.11 156.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.59 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.642 ' HE3' ' HB3' ' B' ' 77' ' ' TYR . 0.0 OUTLIER -151.9 -8.84 0.21 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.526 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.589 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 4.0 t-20 -164.58 73.59 0.24 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.459 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.76 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -118.04 113.37 21.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.485 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.708 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 1.4 m-20 -114.29 32.58 5.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.379 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.887 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.0 OUTLIER -116.65 170.02 8.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.677 -179.68 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.882 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -49.32 129.59 18.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.627 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 47.8 mt-10 -38.32 -70.43 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.035 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.483 ' H ' ' HG2' ' B' ' 16' ' ' GLU . 3.3 mm-40 -48.64 -31.99 7.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.887 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -69.97 -38.59 76.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.883 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -67.31 -38.43 84.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.746 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.747 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 7.3 mm-40 -73.92 -35.83 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.772 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.612 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.5 OUTLIER -72.46 -30.81 64.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.806 179.189 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.794 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.4 OUTLIER -68.61 -42.36 78.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.294 179.487 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.827 HG23 ' O ' ' B' ' 18' ' ' GLN . 12.5 t -66.95 -38.04 80.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.438 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.747 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 18.8 mt-10 -63.78 -39.11 93.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.081 179.307 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 73.0 m -68.72 -34.25 75.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.915 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.844 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -73.14 -33.77 65.69 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.482 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.761 ' HA ' HD12 ' B' ' 29' ' ' LEU . 53.8 m -70.53 -38.43 74.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.296 178.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.407 ' HB3' ' CE1' ' B' ' 41' ' ' HIS . 37.4 mt-30 -58.52 -42.06 86.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.356 178.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.922 ' HB2' ' CD2' ' B' ' 41' ' ' HIS . . . -67.67 -35.85 79.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.133 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.844 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.1 mt -64.1 -38.86 92.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -30.62 59.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.175 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.545 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 1.0 OUTLIER -82.93 -29.48 29.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.875 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.564 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.75 169.04 21.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.629 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.694 ' C ' HD13 ' B' ' 34' ' ' ILE . 11.3 t30 -129.09 30.51 5.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.124 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 1.021 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.8 mm -116.73 106.29 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.918 ' HA ' HD12 ' B' ' 38' ' ' ILE . 1.1 mp0 -29.61 -70.35 0.05 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.769 0.318 . . . . 0.0 110.667 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.402 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -44.12 -43.95 7.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.589 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 1.021 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -64.06 -59.56 4.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.451 179.634 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 1.026 ' HB ' HG11 ' B' ' 58' ' ' VAL . 1.0 OUTLIER -45.35 -53.74 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.665 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.956 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.83 -49.11 50.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.821 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -53.86 -68.23 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.922 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.2 OUTLIER -37.59 -40.92 0.43 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.45 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.873 HG21 HD11 ' B' ' 85' ' ' LEU . 56.9 mt -68.15 -67.66 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.555 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.674 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 6.0 tttp -39.87 -53.42 2.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.267 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.641 ' HE2' ' OH ' ' A' ' 65' ' ' TYR . 23.7 mttm -60.33 -43.98 95.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.415 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.77 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 50.0 tp10 -62.12 -37.2 84.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.296 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.794 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.36 -34.95 73.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.118 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.726 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.3 OUTLIER -68.73 -35.49 77.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.807 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.58 -23.52 21.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.138 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.77 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.97 -26.43 21.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.643 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 1.4 m-85 -127.94 -62.45 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.171 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.643 ' HB3' ' O ' ' B' ' 50' ' ' TYR . 40.2 p-10 154.96 117.12 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.828 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.726 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 10.8 Cg_endo -53.92 169.45 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 122.351 2.034 . . . . 0.0 112.191 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.589 HG21 ' HB ' ' A' ' 67' ' ' THR . 5.8 m -111.37 124.92 53.24 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 122.866 0.467 . . . . 0.0 110.705 0.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.678 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 33.6 m95 -97.53 146.75 24.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.723 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.825 ' NE2' HG22 ' A' ' 67' ' ' THR . 10.5 m170 -111.07 98.79 7.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.108 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.626 ' O ' ' HB1' ' B' ' 39' ' ' ALA . 43.6 t -103.58 124.05 48.08 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -177.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 1.014 HD11 HG13 ' A' ' 66' ' ' VAL . 21.2 mm -121.92 102.54 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.127 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.026 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.6 p -107.24 121.87 60.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.678 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.733 ' O ' ' HB3' ' B' ' 60' ' ' ARG . . . -146.64 -97.24 0.2 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.05 -0.595 . . . . 0.0 111.773 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.733 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 7.8 ptt180 167.59 -27.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -158.6 46.69 0.32 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.667 0.27 . . . . 0.0 111.407 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.793 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 14.8 p90 -96.37 175.41 6.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.659 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.646 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -117.0 83.94 0.36 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.947 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.922 ' HA ' HG12 ' A' ' 57' ' ' ILE . 0.3 OUTLIER -75.73 133.12 40.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 111.432 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.868 ' H ' HG12 ' A' ' 57' ' ' ILE . 22.4 t80 -142.45 61.08 1.44 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.199 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.774 ' HB ' ' CZ ' ' B' ' 86' ' ' PHE . 33.2 m -108.6 168.65 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.678 -179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.515 ' O ' ' CE1' ' A' ' 55' ' ' HIS . 81.8 m -130.72 107.7 9.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.93 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.805 ' CE1' ' HG3' ' B' ' 87' ' ' LYS . 2.3 t-80 -63.92 -143.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.644 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER 171.21 15.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.668 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.899 HG21 ' NZ ' ' B' ' 87' ' ' LYS . 98.0 m -141.97 -96.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.082 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.846 ' HG2' ' HG3' ' B' ' 13' ' ' MET . 0.0 OUTLIER -87.31 14.69 7.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.268 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.708 ' CG ' ' HB3' ' B' ' 12' ' ' ASP . 47.7 m80 76.99 -78.84 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.722 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 12.4 p90 156.5 -169.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.34 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.929 HG23 ' HE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -157.35 114.11 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.021 0.439 . . . . 0.0 111.617 179.804 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.616 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 0.1 OUTLIER -102.27 137.24 40.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.236 179.435 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.929 ' HE1' HG23 ' B' ' 74' ' ' ILE . 0.4 OUTLIER -160.64 159.22 30.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.916 0.389 . . . . 0.0 111.307 -179.821 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.642 ' HB3' ' HE3' ' B' ' 9' ' ' LYS . 7.8 t80 -125.07 112.59 16.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.097 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -71.65 170.5 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.489 179.553 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.543 ' O ' ' HG3' ' B' ' 80' ' ' GLN . . . -24.44 -40.18 0.01 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 121.211 -0.518 . . . . 0.0 113.037 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' B' ' 78' ' ' LEU . 78.3 mt-30 -157.56 40.1 0.29 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.867 0.365 . . . . 0.0 110.803 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.729 HG13 ' O ' ' B' ' 59' ' ' GLY . 98.6 t -154.73 169.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.123 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.842 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -132.36 151.96 51.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.331 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.842 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.2 OUTLIER -140.09 134.55 36.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.076 0.465 . . . . 0.0 111.589 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.938 HD23 ' CG1' ' B' ' 57' ' ' ILE . 0.3 OUTLIER -123.84 97.61 5.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.108 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.873 HD11 HG21 ' B' ' 42' ' ' ILE . 0.5 OUTLIER -100.85 131.62 46.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.975 0.417 . . . . 0.0 111.541 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.774 ' CZ ' ' HB ' ' B' ' 66' ' ' VAL . 0.4 OUTLIER -172.34 123.97 0.49 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.586 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.899 ' NZ ' HG21 ' B' ' 70' ' ' THR . 0.0 OUTLIER -82.29 161.82 22.5 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.779 0.323 . . . . 0.0 110.721 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.687 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -107.57 19.12 20.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.231 0.538 . . . . 0.0 110.767 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 89' ' ' GLY . . . . . 0.473 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.427 -1.207 . . . . 0.0 112.412 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.517 ' HE3' ' HA ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.886 0.374 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.13 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.5 173.9 9.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.369 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.921 HG12 ' HE3' ' A' ' 9' ' ' LYS . 47.9 t -123.92 71.49 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.726 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.992 HD11 HD11 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -41.37 162.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.077 -179.745 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.921 ' HE3' HG12 ' A' ' 7' ' ' VAL . 2.5 mmtt -155.12 -11.3 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 75' ' ' TYR . 6.1 t-20 -176.22 94.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.616 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.903 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.32 84.95 2.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.637 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.746 ' H ' ' HD1' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -73.79 34.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.01 0.433 . . . . 0.0 110.407 179.4 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.768 ' HG3' ' H ' ' A' ' 14' ' ' SER . 12.1 ttp -127.69 170.4 12.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.948 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.768 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.3 OUTLIER -61.91 128.8 37.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.837 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.741 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -34.07 -78.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.15 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.439 ' OE1' ' HG2' ' A' ' 17' ' ' MET . 0.0 OUTLIER -37.21 -35.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.993 -179.896 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.659 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -70.87 -41.6 71.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.166 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.884 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -66.91 -35.33 79.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.604 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 42.5 mm-40 -73.99 -37.92 64.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.139 0.495 . . . . 0.0 109.812 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.25 -31.02 62.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.022 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.777 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -67.8 -40.77 83.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.242 179.308 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.8 HG22 ' CE2' ' A' ' 76' ' ' PHE . 64.0 t -65.52 -50.8 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.604 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 13.3 mt-10 -53.61 -38.79 64.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -37.13 76.59 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.791 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.743 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -68.09 -25.12 65.16 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.114 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.592 ' HA ' HD12 ' A' ' 29' ' ' LEU . 4.2 m -74.93 -45.31 43.29 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.043 -1.435 . . . . 0.0 109.784 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.752 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 53.8 mt-30 -51.82 -47.37 64.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.85 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.782 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -74.42 -26.36 60.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.199 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.937 HD21 HG11 ' A' ' 81' ' ' VAL . 6.6 mt -67.15 -43.58 81.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.14 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -94.13 -10.84 31.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.12 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.755 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 3.7 mttp -85.01 -21.75 29.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 110.588 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.755 ' CE1' ' HB3' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -148.57 -54.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.452 179.374 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.717 ' C ' HD12 ' A' ' 34' ' ' ILE . 1.6 t-20 80.38 26.78 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.385 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.79 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -111.69 91.03 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.851 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.711 ' HG2' ' HA2' ' A' ' 59' ' ' GLY . 3.1 mp0 -14.05 -85.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 O-C-N 123.603 0.564 . . . . 0.0 111.685 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.49 -49.97 2.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.816 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.79 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -57.6 -60.1 4.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.641 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.866 HG22 HD11 ' A' ' 42' ' ' ILE . 51.7 mt -44.43 -51.86 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.91 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -55.9 -38.9 70.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.005 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.774 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -60.41 -66.36 0.54 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.868 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.641 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -50.86 -49.68 58.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.866 HD11 HG22 ' A' ' 38' ' ' ILE . 94.2 mt -50.24 -52.83 13.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.032 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.913 ' HE3' ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -61.75 -70.2 0.2 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.774 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -30.99 -50.31 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' A' ' 49' ' ' LYS . 3.6 mt-10 -63.84 -67.1 0.46 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.795 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.777 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -40.16 -39.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.783 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.751 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 9.8 t70 -68.29 -42.57 79.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.027 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -99.0 9.54 43.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.166 -179.789 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.56 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -117.32 -23.58 7.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.124 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.766 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 84.4 m-85 -120.79 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.272 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.766 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 13.7 t30 162.68 111.81 0.01 OUTLIER Pre-proline 0 N--CA 1.454 -0.245 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.094 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.751 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 81.8 Cg_exo -44.92 156.39 0.25 Allowed 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.372 2.048 . . . . 0.0 112.378 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.685 ' HA ' ' OD1' ' A' ' 47' ' ' ASP . 6.8 m -112.46 138.64 48.92 Favored 'General case' 0 C--N 1.345 0.41 0 C-N-CA 123.037 0.535 . . . . 0.0 110.511 -0.046 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.805 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 70.8 m95 -108.43 140.87 41.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.446 0.641 . . . . 0.0 112.488 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.885 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.1 OUTLIER -135.13 104.41 5.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.836 178.631 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.913 ' HB3' ' HE3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -120.91 165.64 14.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.557 0.694 . . . . 0.0 112.79 -177.676 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.055 HG13 HD23 ' A' ' 84' ' ' LEU . 17.4 mm -132.51 165.21 32.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.601 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.6 p -162.47 108.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.918 0.39 . . . . 0.0 111.541 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.779 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -141.83 -114.62 1.08 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.728 ' HB3' ' O ' ' A' ' 59' ' ' GLY . 0.7 OUTLIER 166.68 -12.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.636 0.255 . . . . 0.0 111.657 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -157.78 40.27 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.672 0.272 . . . . 0.0 111.128 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 1.022 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -106.69 -169.5 1.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.951 0.405 . . . . 0.0 111.021 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.892 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.59 86.4 0.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.974 ' HB2' HD22 ' A' ' 84' ' ' LEU . 70.6 p -81.19 129.23 34.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.209 0.528 . . . . 0.0 111.779 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.782 ' H ' HD13 ' B' ' 57' ' ' ILE . 15.7 t80 -137.65 70.65 1.39 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.067 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.001 HG13 HD11 ' B' ' 57' ' ' ILE . 3.4 m -100.56 166.62 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.709 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.714 HG21 ' OG1' ' B' ' 53' ' ' THR . 1.4 m -114.32 68.53 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.57 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.5 ' NE2' ' CB ' ' A' ' 12' ' ' ASP . 37.0 p-80 -62.85 -167.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.571 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.511 ' HB2' ' H ' ' A' ' 70' ' ' THR . 0.7 OUTLIER -176.15 -140.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.786 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.515 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER 36.76 -99.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.265 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.748 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 175.1 27.04 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.893 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.717 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 98.4 m-70 -119.4 49.14 1.39 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.435 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.746 ' HD1' ' H ' ' A' ' 12' ' ' ASP . 0.3 OUTLIER -128.15 126.44 41.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 -179.7 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.992 HD11 HD11 ' A' ' 8' ' ' ILE . 1.4 tt -134.72 137.48 50.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.997 0.427 . . . . 0.0 111.342 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 10' ' ' ASN . 16.8 t80 -124.06 129.67 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.036 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.971 ' HE1' HG23 ' A' ' 74' ' ' ILE . 0.5 OUTLIER -159.1 167.7 28.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.01 0.433 . . . . 0.0 111.358 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.661 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 28.2 t80 -131.21 93.29 3.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.546 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.13 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -48.87 175.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.957 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -29.66 -54.27 0.19 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.665 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.41 32.65 1.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.865 0.364 . . . . 0.0 110.961 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.937 HG11 HD21 ' A' ' 29' ' ' LEU . 60.1 t -146.49 170.85 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.056 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.924 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -131.48 153.43 49.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.713 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.924 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -144.27 121.57 5.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.925 0.393 . . . . 0.0 111.42 -179.786 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.055 HD23 HG13 ' A' ' 57' ' ' ILE . 3.2 tp -112.41 90.74 3.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.317 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.774 ' HG ' ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -94.76 146.21 24.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.87 -179.32 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.728 ' HB3' ' HD2' ' A' ' 73' ' ' PHE . 7.8 p90 177.21 140.56 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.936 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.851 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 6.4 mtpm? -99.18 -179.03 4.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.987 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.885 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.265 0.555 . . . . 0.0 110.723 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.724 HH22 HD13 ' B' ' 8' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.771 0.32 . . . . 0.0 111.009 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' B' ' 5' ' ' LYS . 11.1 mmmt 39.45 28.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.531 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.006 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.44 -167.47 1.77 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.067 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.694 ' O ' ' HE2' ' B' ' 9' ' ' LYS . 75.7 t -152.88 74.33 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.972 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.815 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -42.84 159.78 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.236 0.541 . . . . 0.0 110.861 -179.857 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.694 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 5.7 mmtt -152.15 -14.73 0.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.896 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.579 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.9 OUTLIER -171.4 108.69 0.27 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.778 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.784 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -141.61 102.77 4.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.876 0.37 . . . . 0.0 111.653 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.792 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 1.7 t70 -85.77 26.28 0.99 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.439 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.884 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 11.0 ttp -114.89 157.53 23.2 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.743 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.745 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -46.24 152.6 0.4 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.619 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.894 ' HA ' HE21 ' B' ' 18' ' ' GLN . 2.5 mt-10 -56.48 -70.27 0.12 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.127 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.463 ' HA ' ' HG2' ' B' ' 19' ' ' GLN . 0.8 OUTLIER -49.58 -25.67 2.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.989 0.423 . . . . 0.0 110.533 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.797 ' HE2' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -74.3 -41.9 60.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.828 179.796 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.894 HE21 ' HA ' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -68.47 -25.37 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.68 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.702 ' HG3' ' N ' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -78.46 -39.98 36.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.016 179.498 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.702 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 0.3 OUTLIER -72.96 -24.4 60.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.053 179.213 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.793 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -74.4 -48.04 30.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.27 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.848 HG13 ' CE2' ' B' ' 76' ' ' PHE . 37.4 t -61.91 -39.76 84.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.463 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.527 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 68.7 mt-10 -66.12 -38.81 89.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.067 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' B' ' 20' ' ' ASP . 99.2 m -67.62 -35.25 78.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.712 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.76 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -69.49 -35.8 75.9 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 178.172 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.819 ' HA ' HD12 ' B' ' 29' ' ' LEU . 88.2 m -65.05 -42.12 94.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.522 178.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 32.5 mt-30 -54.35 -46.81 73.05 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.585 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.78 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -74.01 -16.89 61.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.186 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' B' ' 26' ' ' THR . 3.3 mt -80.66 -41.33 23.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.107 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -78.75 -30.22 45.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.799 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.681 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 7.8 mmtp -84.4 -19.46 33.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.623 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.681 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -158.34 149.89 21.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.813 179.679 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.31 27.45 9.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.7 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 1.017 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.3 mm -108.43 106.42 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.928 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.892 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 35.7 mp0 -30.24 -70.71 0.05 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.527 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.33 -60.31 2.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.691 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 1.017 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.1 OUTLIER -44.48 -65.41 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.55 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.78 HG23 ' CB ' ' B' ' 28' ' ' ALA . 10.9 mt -46.64 -45.12 7.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.325 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -61.99 -43.77 98.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.394 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.531 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -60.82 -64.86 0.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.689 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -42.37 -56.14 3.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.76 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 55.7 mt -46.82 -68.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.637 ' HD3' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -36.45 -57.15 0.77 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.265 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -52.61 -39.74 61.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.462 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.593 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -73.53 -41.88 62.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.196 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.793 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.9 -37.39 87.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.74 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.858 ' HB3' ' HG3' ' B' ' 52' ' ' PRO . 8.0 m-20 -68.32 -46.24 70.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' B' ' 48' ' ' LYS . 22.0 mmmt -79.19 -25.11 42.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.6 tttm -90.16 -12.44 38.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.155 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.55 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 86.0 m-85 -133.39 -71.43 0.51 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.344 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.9 m-20 157.85 107.46 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.069 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.858 ' HG3' ' HB3' ' B' ' 47' ' ' ASP . 72.0 Cg_exo -35.58 156.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.52 2.147 . . . . 0.0 112.691 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.735 HG23 ' CE1' ' B' ' 55' ' ' HIS . 4.7 t -120.94 123.26 42.04 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 123.016 0.527 . . . . 0.0 111.006 -0.02 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.962 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 37.6 m95 -92.79 118.99 31.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.915 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.812 ' HE2' ' HB2' ' B' ' 88' ' ' SER . 1.9 m-70 -99.54 99.39 10.26 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.764 ' CB ' HD12 ' B' ' 85' ' ' LEU . 24.4 p -114.96 146.39 41.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.264 0.554 . . . . 0.0 112.471 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 1.001 HD11 HG13 ' A' ' 66' ' ' VAL . 22.7 mm -128.19 111.51 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.184 178.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -111.11 135.24 50.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.877 0.37 . . . . 0.0 111.634 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.594 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -165.22 -137.52 2.22 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.967 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.593 ' O ' ' ND2' ' B' ' 61' ' ' ASN . 0.1 OUTLIER -172.33 34.07 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 120.775 0.321 . . . . 0.0 111.269 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.593 ' ND2' ' O ' ' B' ' 60' ' ' ARG . 0.6 OUTLIER 163.81 27.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.776 179.815 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 1.022 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.7 p90 -100.67 165.81 11.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.661 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -121.12 84.29 0.37 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.976 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.905 ' CB ' HD22 ' B' ' 84' ' ' LEU . 3.0 p -79.76 139.27 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.006 0.432 . . . . 0.0 111.444 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.82 ' H ' HD13 ' A' ' 57' ' ' ILE . 4.1 t80 -149.17 64.18 1.03 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.446 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.703 ' HA ' ' HB3' ' A' ' 55' ' ' HIS . 24.3 m -101.78 140.79 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.532 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 17.4 m -85.33 95.43 9.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.612 ' HB3' ' CG ' ' B' ' 73' ' ' PHE . 14.8 p-80 -57.52 -150.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.809 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.727 ' O ' HG22 ' B' ' 70' ' ' THR . 0.0 OUTLIER 168.73 116.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 70' ' ' THR . . . . . 1.092 HG23 ' HG2' ' B' ' 71' ' ' LYS . 0.5 OUTLIER 81.01 -59.4 0.26 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.476 179.625 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 1.092 ' HG2' HG23 ' B' ' 70' ' ' THR . 0.0 OUTLIER 174.53 -158.44 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.874 -179.756 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.884 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 29.7 m170 64.1 17.77 10.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.855 ' HA ' ' HA ' ' B' ' 86' ' ' PHE . 4.0 t80 -114.26 77.36 1.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.478 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.789 HD13 ' CE1' ' B' ' 76' ' ' PHE . 1.6 tt -96.0 149.05 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.126 0.489 . . . . 0.0 111.469 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.579 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.3 OUTLIER -140.79 125.5 18.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.619 179.145 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.848 ' CE2' HG13 ' B' ' 22' ' ' VAL . 4.5 p90 -155.3 167.38 30.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.975 0.417 . . . . 0.0 111.24 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 10.9 t80 -124.06 111.02 15.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.976 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.006 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -72.65 170.48 14.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.678 179.711 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.498 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.23 -50.0 0.05 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.695 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -146.05 37.59 1.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.958 0.409 . . . . 0.0 110.692 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.817 HG11 HD21 ' B' ' 29' ' ' LEU . 93.3 t -152.08 170.4 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.863 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.709 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -142.66 115.01 8.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 0.0 110.919 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.71 HD13 HG23 ' B' ' 58' ' ' VAL . 0.4 OUTLIER -101.75 129.77 52.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.253 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.905 HD22 ' CB ' ' B' ' 64' ' ' SER . 0.3 OUTLIER -118.2 87.14 2.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.532 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.764 HD12 ' CB ' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -89.46 134.62 34.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.855 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -160.27 126.86 4.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.962 ' HG3' ' HA ' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -110.32 142.95 41.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.024 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.812 ' HB2' ' HE2' ' B' ' 55' ' ' HIS . 0.2 OUTLIER -86.21 19.35 2.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.211 0.529 . . . . 0.0 110.729 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.421 -1.21 . . . . 0.0 112.506 179.901 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.672 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.699 0.285 . . . . 0.0 110.807 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.998 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 160.59 168.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.915 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.672 HG12 ' O ' ' A' ' 7' ' ' VAL . 98.8 t -131.13 60.75 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.929 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.859 HD11 HD11 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -36.04 132.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.694 -179.897 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -114.33 -16.29 12.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.984 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.595 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 1.7 m-20 -173.99 160.06 3.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.665 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.595 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 171.07 113.86 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.778 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.732 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 41.6 m-20 -98.52 27.62 4.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.024 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.896 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -107.59 168.02 9.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.562 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.896 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -53.69 146.83 12.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.882 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.721 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -56.53 -62.01 2.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.764 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' ' 16' ' ' GLU . 2.6 mp0 -53.96 -24.99 18.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.857 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.586 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 60.2 mmm -77.67 -45.86 23.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.99 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.854 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -61.77 -33.16 73.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.72 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -75.53 -40.37 57.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.149 0.499 . . . . 0.0 109.7 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.766 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 1.4 m-20 -69.73 -30.81 68.5 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.548 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -64.45 -50.31 68.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.824 179.198 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.775 HG22 ' CD2' ' A' ' 76' ' ' PHE . 70.3 t -55.43 -47.4 78.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.009 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -53.73 -39.3 65.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.161 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.53 ' HG ' ' HD1' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -65.43 -41.32 93.64 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.045 179.24 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.668 ' HB2' HG21 ' A' ' 83' ' ' ILE . . . -66.69 -28.94 68.85 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.685 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.6 OUTLIER -72.73 -42.25 64.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.641 178.655 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -51.62 -46.06 63.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.528 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.926 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -81.07 -20.55 41.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.683 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.739 HD11 ' HG ' ' A' ' 78' ' ' LEU . 6.7 mt -77.46 -29.93 52.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.249 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 -34.77 14.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.204 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.563 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -82.9 -14.14 54.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.449 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.633 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.35 169.7 22.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.761 179.535 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.725 ' C ' HD13 ' A' ' 34' ' ' ILE . 1.3 t30 -137.93 29.18 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.913 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 1.2 mm -116.63 108.22 24.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.065 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.682 ' HA ' HD12 ' A' ' 38' ' ' ILE . 23.6 mp0 -29.1 -74.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.503 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.4 OUTLIER -42.61 -61.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.753 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.913 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.3 OUTLIER -44.43 -62.85 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.926 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 3.3 mt -45.18 -48.46 3.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.868 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -57.94 -43.85 86.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.071 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.799 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.94 -64.77 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.067 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.692 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -49.15 -56.8 8.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.931 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.815 HD11 HG22 ' A' ' 38' ' ' ILE . 47.3 mt -42.52 -62.52 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.952 ' HE2' ' H ' ' A' ' 54' ' ' TRP . 13.0 tptp -51.49 -60.44 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.01 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -36.93 -56.02 0.89 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.069 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 48' ' ' LYS . 18.3 tt0 -60.97 -69.06 0.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.3 OUTLIER -37.35 -38.16 0.22 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.315 -179.84 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.708 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.1 OUTLIER -71.58 -38.52 70.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.471 -179.467 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.478 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -101.64 9.96 40.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.723 0.297 . . . . 0.0 111.373 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.42 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -125.54 -7.48 6.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.323 -179.899 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.766 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 39.8 m-85 -133.04 -63.3 0.77 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.994 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 1.0 OUTLIER 161.79 108.86 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.313 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.708 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 73.0 Cg_exo -49.53 153.56 5.11 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.446 2.097 . . . . 0.0 112.434 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . 1.027 HG21 HG21 ' B' ' 67' ' ' THR . 44.5 m -117.06 137.11 52.48 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 122.998 0.519 . . . . 0.0 110.699 0.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.952 ' H ' ' HE2' ' A' ' 43' ' ' LYS . 64.8 m95 -98.76 160.81 14.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.39 0.614 . . . . 0.0 111.748 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.859 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 1.7 m80 -141.26 100.42 3.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.016 179.247 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.943 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.8 OUTLIER -113.27 144.35 42.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.355 0.597 . . . . 0.0 112.573 -178.051 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.976 HG12 HD23 ' A' ' 84' ' ' LEU . 18.0 mm -132.87 111.82 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.334 179.039 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.868 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.8 p -111.01 126.83 68.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.933 0.397 . . . . 0.0 111.58 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.609 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -147.48 -151.34 5.4 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.677 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.5 26.02 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.773 0.287 . . . . 0.0 111.586 -179.75 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.677 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 164.5 26.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 0.0 111.143 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.861 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 14.8 p90 -102.67 -179.54 4.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.842 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.786 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -132.6 108.57 0.78 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.785 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.861 ' HB3' ' HE1' ' A' ' 62' ' ' PHE . 7.2 p -93.94 124.75 38.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.982 0.42 . . . . 0.0 111.53 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.814 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 33.1 t80 -135.8 82.14 1.93 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.376 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.851 HG13 HD11 ' B' ' 57' ' ' ILE . 14.6 m -125.89 152.27 32.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.4 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' THR . . . . . 1.032 HG21 HG21 ' B' ' 53' ' ' THR . 0.6 OUTLIER -79.49 115.71 19.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.617 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.821 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -74.87 148.41 40.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.96 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.752 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 3.5 mm-40 -113.94 -131.52 0.32 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.481 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.583 ' OG1' ' N ' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -27.57 -99.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.679 -179.56 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.751 ' O ' ' HB2' ' A' ' 13' ' ' MET . 0.1 OUTLIER -70.29 22.49 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.962 0.41 . . . . 0.0 110.697 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.821 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 24.6 m-70 56.97 -85.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.874 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.744 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 164.61 -170.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.895 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.859 HD11 HD11 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -160.34 110.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.597 179.771 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.597 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 34.6 t80 -103.71 137.26 42.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.605 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.84 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.5 OUTLIER -151.17 169.73 21.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.81 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.777 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 10.2 t80 -126.59 98.11 5.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.002 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.998 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.3 OUTLIER -59.46 177.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.73 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.546 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -56.63 81.4 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.464 179.334 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.777 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.7 OUTLIER 84.1 22.87 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.177 0.513 . . . . 0.0 110.016 -178.9 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.907 ' HB ' ' HB2' ' A' ' 78' ' ' LEU . 72.5 t -142.63 173.02 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.75 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.756 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -146.25 146.26 30.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.695 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.817 HD13 HG23 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -135.79 133.1 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.008 0.432 . . . . 0.0 111.531 -179.517 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.976 HD23 HG12 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -118.34 93.96 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.045 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.766 HD11 HG21 ' A' ' 42' ' ' ILE . 0.7 OUTLIER -98.81 124.67 43.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.636 -179.155 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.782 ' CE1' HG21 ' A' ' 66' ' ' VAL . 18.7 p90 -162.72 129.95 3.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.049 179.43 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.835 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 1.0 OUTLIER -104.87 151.17 24.16 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.926 0.393 . . . . 0.0 111.159 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.808 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-O 121.329 0.585 . . . . 0.0 110.741 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . 27.0 mmt-85 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.724 0.297 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.505 ' O ' HG11 ' B' ' 22' ' ' VAL . 0.0 OUTLIER 72.51 174.36 0.29 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.828 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.03 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 66.06 164.64 0.18 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.422 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.601 ' O ' ' HG2' ' B' ' 9' ' ' LYS . 24.3 t -130.43 71.9 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.739 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.814 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -32.08 152.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.77 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.824 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 1.8 mmpt? -147.16 -6.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.511 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.602 ' HB3' ' HZ ' ' B' ' 73' ' ' PHE . 3.3 m-20 -176.65 90.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.516 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.878 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -127.98 97.74 4.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.423 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.83 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 1.4 m-20 -95.07 25.96 3.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.067 0.46 . . . . 0.0 110.393 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.726 ' HG3' ' H ' ' B' ' 14' ' ' SER . 12.8 ttp -110.4 168.78 9.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.544 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.726 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.6 OUTLIER -49.24 125.83 11.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.766 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.723 ' HA ' HE21 ' B' ' 18' ' ' GLN . 45.9 mt-10 -39.29 -56.37 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.785 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -56.41 -30.6 62.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.532 ' CB ' ' HG2' ' B' ' 13' ' ' MET . 30.8 mmm -72.82 -44.09 61.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.071 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 1.032 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -62.94 -32.39 73.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -75.03 -42.77 56.56 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.196 0.522 . . . . 0.0 109.682 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.55 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 25.1 m-20 -68.1 -28.87 67.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.511 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.786 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -66.67 -48.62 68.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.956 179.094 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.825 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 90.9 t -55.27 -50.15 66.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.136 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.83 -34.99 68.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.948 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.473 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 3.2 m -69.55 -36.12 76.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.754 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.77 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.36 -28.81 64.32 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 3.7 m -74.31 -40.39 62.27 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.75 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.769 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 6.9 mm100 -56.6 -44.43 81.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.681 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.978 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -68.21 -36.7 79.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.067 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.77 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.8 mt -65.46 -41.08 93.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -25.88 54.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.736 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.769 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 23.6 mmtm -88.12 -22.65 23.99 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.687 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.53 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -159.66 163.71 34.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.699 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.469 ' OD1' ' N ' ' B' ' 33' ' ' ASN . 0.0 OUTLIER -123.28 29.75 6.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.935 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.746 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.7 mm -113.67 106.41 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.892 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.786 ' HB3' ' HA3' ' A' ' 63' ' ' GLY . 1.2 mp0 -29.89 -70.34 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.898 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.438 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -43.33 -52.33 5.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.633 179.559 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.746 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 7.0 t0 -55.49 -60.49 3.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.369 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.978 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 3.8 mt -42.74 -55.1 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.713 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.98 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.46 -53.73 21.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.814 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -51.37 -69.29 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.263 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.755 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -33.78 -42.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.359 179.134 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.747 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 53.6 mt -69.04 -66.35 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.324 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.596 ' HD3' ' CD1' ' A' ' 65' ' ' TYR . 7.3 tttp -40.49 -43.55 1.86 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.075 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -69.02 -49.4 58.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.277 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.561 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 41.6 tt0 -63.22 -25.95 68.57 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.786 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -79.33 -37.81 36.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.874 0.369 . . . . 0.0 110.771 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.933 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.62 -32.82 73.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.609 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.4 mmmt -90.56 -33.78 15.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.221 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 7.7 tttp -81.03 -12.66 59.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.387 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.751 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 17.4 m-85 -142.75 -66.59 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.658 0.266 . . . . 0.0 111.596 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.751 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.2 t30 160.74 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.398 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.933 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 21.0 Cg_endo -60.43 169.42 5.29 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.472 2.115 . . . . 0.0 112.377 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 53' ' ' THR . . . . . 1.032 HG21 HG21 ' A' ' 67' ' ' THR . 1.8 t -110.89 120.73 43.37 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 122.926 0.49 . . . . 0.0 110.733 0.077 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.856 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 31.2 m95 -90.55 141.23 28.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.46 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.815 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 4.1 m170 -107.1 105.39 15.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.338 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.69 ' O ' HD13 ' B' ' 57' ' ' ILE . 9.8 t -111.74 133.08 54.21 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.156 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.997 ' CG1' HD23 ' B' ' 84' ' ' LEU . 23.8 mm -127.08 99.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.56 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 0.98 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.6 p -104.98 118.78 52.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.048 0.451 . . . . 0.0 111.847 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.905 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -134.87 -116.03 1.59 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.198 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -174.15 -31.86 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.786 0.327 . . . . 0.0 111.022 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -154.67 43.11 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.925 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.913 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 27.9 p90 -99.68 -167.15 1.42 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 0.0 111.07 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.681 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -140.5 98.11 0.23 Allowed Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.709 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.941 ' CB ' HD22 ' B' ' 84' ' ' LEU . 3.8 p -89.22 128.42 35.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.996 0.427 . . . . 0.0 111.668 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.799 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 52.5 t80 -139.48 86.54 2.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.343 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.922 HG13 HD11 ' A' ' 57' ' ' ILE . 12.2 m -136.92 141.42 40.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.179 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 67' ' ' THR . . . . . 1.027 HG21 HG21 ' A' ' 53' ' ' THR . 1.3 t -70.37 139.54 51.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.043 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.783 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -98.76 162.15 13.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.532 ' HB2' ' H ' ' B' ' 70' ' ' THR . 0.1 OUTLIER -131.75 -101.26 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.33 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.557 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -46.04 -108.08 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.389 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.687 ' O ' ' HB2' ' B' ' 13' ' ' MET . 2.1 mmtp -70.5 29.3 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.88 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.83 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 37.9 m-70 57.22 -83.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.778 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 163.05 -153.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.73 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 1.032 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.6 OUTLIER -172.54 135.6 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.549 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.824 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 5.2 t80 -124.05 139.62 53.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.999 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.825 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 0.8 OUTLIER -165.73 147.11 7.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.977 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.723 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 64.5 t80 -112.7 109.5 19.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.03 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.4 mm? -69.1 169.55 11.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.061 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.543 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -19.75 -67.86 0.01 OUTLIER Glycine 0 C--N 1.335 0.479 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.86 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.422 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 0.7 OUTLIER -130.86 39.0 3.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.049 0.452 . . . . 0.0 110.064 179.223 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.905 HG13 ' O ' ' B' ' 59' ' ' GLY . 93.0 t -152.69 170.18 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.114 -179.385 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.99 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -131.51 162.15 30.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.367 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.99 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -145.61 133.98 16.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.977 0.417 . . . . 0.0 111.489 -179.615 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.997 HD23 ' CG1' ' B' ' 57' ' ' ILE . 4.9 tp -124.15 88.19 2.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.444 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.757 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -95.02 122.33 37.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.246 -179.44 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.838 ' CE2' HG21 ' B' ' 66' ' ' VAL . 0.5 OUTLIER -153.52 120.1 5.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.022 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.856 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -86.22 132.06 34.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.893 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.815 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 2.4 m -94.73 19.53 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.228 0.537 . . . . 0.0 110.956 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 89' ' ' GLY . . . . . 0.471 ' OXT' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.368 -1.24 . . . . 0.0 112.525 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.758 0.313 . . . . 0.0 111.295 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.095 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -131.07 -171.05 2.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.128 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.451 ' N ' ' O ' ' A' ' 77' ' ' TYR . 25.9 t -145.79 78.69 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.262 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.802 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 1.4 mp -40.03 142.41 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.479 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 3.7 mmpt? -129.83 -12.78 4.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.03 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.57 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 14.4 t30 -154.89 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 1.086 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 76.68 -176.59 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.619 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.777 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 1.0 OUTLIER 162.23 22.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.807 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.923 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 11.0 ttp -114.58 164.59 13.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.687 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . 1.044 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 68.5 m -45.3 135.27 6.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.522 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.473 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.2 mm-40 -41.67 -75.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.071 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -44.68 -22.15 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' MET . . . . . 1.044 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.54 -39.73 31.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.816 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -67.73 -30.1 69.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.589 179.811 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -45.77 19.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -68.18 -29.49 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.484 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.816 ' OG ' HG21 ' A' ' 74' ' ' ILE . 0.2 OUTLIER -66.66 -50.83 61.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.086 179.182 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.819 ' HA ' ' CZ ' ' A' ' 76' ' ' PHE . 58.0 t -57.13 -40.36 72.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.343 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.85 -34.66 78.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.203 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -71.78 -34.06 69.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.764 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.696 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -73.42 -34.15 65.33 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.832 ' HA ' HD12 ' A' ' 29' ' ' LEU . 42.0 m -71.71 -40.19 69.64 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.619 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.823 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -56.17 -43.33 78.28 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.249 178.94 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.943 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -74.93 -22.92 58.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.807 178.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.832 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.9 mt -73.46 -38.38 65.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.945 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.01 -25.21 26.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.768 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -83.92 -35.27 24.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.725 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.654 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -149.92 150.58 32.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.627 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.664 ' HA ' HD11 ' A' ' 38' ' ' ILE . 34.4 t30 -127.51 48.57 2.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.772 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.887 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 40.4 mm -115.45 43.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.701 ' HG2' ' HA ' ' B' ' 62' ' ' PHE . 3.1 mp0 34.56 -87.56 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.596 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.613 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -43.19 -53.75 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.865 0.364 . . . . 0.0 110.456 179.53 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.887 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.4 t70 -45.86 -61.94 1.52 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.588 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.943 HG23 ' HB3' ' A' ' 28' ' ' ALA . 3.7 mt -45.5 -58.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.933 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -49.29 -54.61 16.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.718 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -42.53 -55.24 3.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.111 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.539 ' CE1' ' CD1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.817 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.703 ' CG2' HD11 ' A' ' 85' ' ' LEU . 64.2 mt -47.68 -69.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.218 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.852 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -49.97 -67.08 0.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.987 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.788 ' HD2' ' N ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -33.0 -59.69 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.911 -179.974 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.788 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 5.2 tp10 -54.66 -54.84 36.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.704 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -52.66 -31.65 38.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.942 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.73 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -72.94 -32.15 65.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.872 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mmmm -106.27 4.61 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.372 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.484 ' O ' ' CG ' ' A' ' 50' ' ' TYR . 6.2 tttp -123.98 13.75 9.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.789 0.328 . . . . 0.0 111.101 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.675 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 57.2 m-85 -159.94 -66.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.12 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.488 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 1.3 t30 162.09 115.57 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.726 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.73 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 36.4 Cg_endo -64.98 170.49 10.25 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.433 2.089 . . . . 0.0 112.398 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.68 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.5 t -102.65 128.12 49.47 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 122.86 0.464 . . . . 0.0 110.358 -0.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.836 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 63.6 m95 -94.27 151.44 19.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.407 0.622 . . . . 0.0 111.929 -179.08 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.826 ' HB2' ' CE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -136.67 94.19 2.96 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.954 179.257 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.995 ' HB2' HD12 ' A' ' 85' ' ' LEU . 8.8 p -115.97 154.9 29.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.349 0.595 . . . . 0.0 112.422 -178.122 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.994 HD12 ' HA ' ' B' ' 64' ' ' SER . 16.3 mm -126.96 174.71 10.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.001 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.933 HG12 ' HB2' ' A' ' 39' ' ' ALA . 8.1 p -170.88 110.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.961 0.41 . . . . 0.0 111.76 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.686 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.39 -135.83 2.15 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.765 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.447 ' H ' ' H ' ' A' ' 61' ' ' ASN . 4.5 ptt180 -173.69 -9.85 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.447 ' H ' ' H ' ' A' ' 60' ' ' ARG . 16.3 p30 -148.72 44.83 1.02 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.087 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.849 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -120.19 165.73 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.93 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.854 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -112.77 86.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.792 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.952 ' HA ' HG23 ' B' ' 57' ' ' ILE . 2.9 p -81.91 118.56 23.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.045 0.45 . . . . 0.0 111.58 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.984 ' H ' HD13 ' B' ' 57' ' ' ILE . 7.4 t80 -132.37 76.68 1.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.006 HG13 HD11 ' B' ' 57' ' ' ILE . 5.5 m -127.55 140.44 49.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.824 HG21 HG21 ' B' ' 53' ' ' THR . 3.3 t -95.69 120.52 36.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.435 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -60.95 -164.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.876 -179.89 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.521 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 1.0 OUTLIER -127.11 -46.84 1.5 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.346 -179.752 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.504 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 28.3 m -157.92 -42.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.481 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.777 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 7.7 mtpt -164.7 -159.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.758 0.313 . . . . 0.0 110.882 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 1.044 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 0.0 OUTLIER 56.17 18.82 3.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.011 0.434 . . . . 0.0 110.436 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.829 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 7.0 t80 -116.15 101.61 8.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.498 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 1.086 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -121.4 118.25 55.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.316 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -115.21 94.6 4.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.763 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.819 ' CZ ' ' HA ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -114.7 -178.88 3.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.164 -179.778 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.688 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 16.1 t80 -140.31 102.69 4.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.095 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -59.64 173.05 0.6 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.273 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.96 -44.86 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.936 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.418 ' N ' ' O ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -148.21 26.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.22 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.754 HG11 HD21 ' A' ' 29' ' ' LEU . 72.2 t -139.65 168.3 18.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.989 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.723 ' O ' ' HA ' ' A' ' 58' ' ' VAL . . . -136.63 125.88 24.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.594 HG21 ' CB ' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -113.23 119.99 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.993 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.981 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 21.4 tp -100.78 80.45 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.18 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.995 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -86.32 137.78 32.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.072 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.829 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -174.23 127.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.563 179.635 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 1.044 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -90.14 -169.75 2.53 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.925 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.521 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-O 121.308 0.575 . . . . 0.0 110.81 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.42 ' O ' ' CB ' ' B' ' 5' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.457 -0.093 0 CA-C-O 120.868 0.366 . . . . 0.0 110.684 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.632 ' HG2' ' H ' ' B' ' 6' ' ' ALA . 22.8 tttt 76.62 -152.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.724 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.075 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 52.74 175.85 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.183 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.748 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 59.0 t -147.83 71.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.727 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.793 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -34.8 140.32 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.521 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.748 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 3.2 mmtp -115.27 -25.58 7.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.213 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -140.83 -87.97 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.165 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 1.066 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 62.64 106.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.095 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -109.28 24.32 13.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.648 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.761 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -107.82 173.31 6.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.761 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.2 OUTLIER -54.61 128.0 30.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.856 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.613 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 1.7 mm-40 -39.85 -64.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -50.36 -27.45 6.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.548 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.647 ' HB2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -75.55 -31.61 60.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.701 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 1.054 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.5 OUTLIER -71.29 -36.2 71.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.395 179.65 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.556 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 67.9 mt-30 -74.82 -35.57 62.44 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.88 -34.91 62.29 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.856 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 1.4 t -65.19 -42.49 93.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.756 179.05 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.964 HG22 ' CD2' ' B' ' 76' ' ' PHE . 91.2 t -60.94 -50.0 82.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.332 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.556 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 20.7 mt-10 -53.75 -38.61 64.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.297 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.598 ' SG ' ' CE1' ' B' ' 46' ' ' PHE . 71.9 m -65.71 -38.46 89.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.011 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.805 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -68.77 -30.2 68.75 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.412 ' H ' ' HG1' ' B' ' 26' ' ' THR . 0.7 OUTLIER -72.43 -40.2 67.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.361 -1.291 . . . . 0.0 109.926 178.787 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.857 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -56.86 -43.77 81.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.892 179.354 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 1.061 ' HB3' HG23 ' B' ' 38' ' ' ILE . . . -73.51 -34.29 65.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.423 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.805 HD12 ' O ' ' B' ' 25' ' ' ALA . 2.3 mt -65.53 -40.82 93.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.876 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.96 -18.52 34.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 1.1 mmmm -83.38 -21.14 33.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.822 ' CB ' HD13 ' B' ' 34' ' ' ILE . 0.1 OUTLIER -153.01 -49.0 0.1 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.792 -179.921 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.611 ' C ' HD12 ' B' ' 34' ' ' ILE . 0.2 OUTLIER 83.37 28.42 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.777 -179.561 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.822 HD13 ' CB ' ' B' ' 32' ' ' TYR . 1.1 mp -111.2 140.76 29.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.736 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.854 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -53.91 -70.91 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.897 0.379 . . . . 0.0 110.62 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.527 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -54.18 -55.86 23.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.609 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 12.3 t0 -47.4 -60.74 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.723 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 1.061 HG23 ' HB3' ' B' ' 28' ' ' ALA . 26.6 mt -46.88 -60.66 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.982 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.764 ' CB ' ' HB2' ' A' ' 65' ' ' TYR . . . -40.94 -46.1 2.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 0.0 110.562 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.819 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -63.08 -62.93 1.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.406 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.857 ' NE2' ' HB3' ' B' ' 27' ' ' GLN . 0.8 OUTLIER -39.23 -42.3 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.59 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.783 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 7.9 mt -72.47 -70.14 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.256 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.831 ' NZ ' HG23 ' B' ' 53' ' ' THR . 27.9 tttp -36.97 -48.02 0.74 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.642 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 6.5 mttt -62.39 -56.03 22.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.261 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.777 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -57.01 -58.32 8.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.831 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.856 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -40.57 -64.24 0.55 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.958 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.789 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 2.8 p30 -46.4 -42.41 15.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.844 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.777 ' HG3' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -69.93 -36.87 75.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.865 -179.379 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.466 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.35 -9.66 46.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.693 -179.212 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.753 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 92.8 m-85 -127.5 -70.05 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.454 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.753 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 5.7 t-20 161.06 109.45 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.035 -179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.789 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 96.8 Cg_exo -43.53 154.65 0.2 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 122.344 2.029 . . . . 0.0 112.479 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.831 HG23 ' NZ ' ' B' ' 43' ' ' LYS . 6.1 m -119.2 134.62 55.11 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 122.927 0.491 . . . . 0.0 110.652 0.017 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.789 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 45.0 m95 -100.12 125.71 46.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.055 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.727 ' HB2' ' O ' ' B' ' 86' ' ' PHE . 62.8 m170 -93.77 94.76 8.72 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.726 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.7 OUTLIER -102.52 151.39 22.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -177.37 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 1.06 HG13 HD23 ' B' ' 84' ' ' LEU . 13.7 mm -139.83 155.82 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.386 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 0.816 HG23 HG11 ' B' ' 81' ' ' VAL . 1.5 p -162.11 109.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 111.59 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.841 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -136.23 -123.28 2.26 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.832 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 60' ' ' ARG . 0.8 OUTLIER -166.09 -23.88 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.57 0.224 . . . . 0.0 111.523 179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.607 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 1.5 m-20 -157.61 46.25 0.37 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.824 0.345 . . . . 0.0 111.282 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.849 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.2 p90 -102.88 175.08 5.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.938 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.79 87.43 0.41 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.375 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.994 ' HA ' HD12 ' A' ' 57' ' ' ILE . 10.9 p -85.21 121.64 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.958 0.409 . . . . 0.0 111.105 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.852 ' HE2' ' HD2' ' A' ' 43' ' ' LYS . 11.6 t80 -134.18 61.33 1.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.629 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.942 HG13 HD11 ' A' ' 57' ' ' ILE . 17.5 m -96.7 164.65 2.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.16 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.671 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 93.5 m -101.7 98.93 9.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.861 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -43.36 169.85 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.717 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.8 OUTLIER -142.13 -119.78 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.99 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.568 ' C ' ' H ' ' B' ' 72' ' ' HIS . 41.5 p -39.4 -98.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.014 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' B' ' 13' ' ' MET . 3.4 mmmm -68.74 18.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.77 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.861 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 20.1 m170 65.78 -88.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.765 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 2.4 p90 165.74 -176.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.0 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 1.066 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -156.67 114.63 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.545 179.305 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.811 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 1.3 t80 -100.4 137.71 38.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.918 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.964 ' CD2' HG22 ' B' ' 22' ' ' VAL . 1.0 OUTLIER -162.62 156.83 21.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.824 0.345 . . . . 0.0 111.376 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 2.1 t80 -116.89 112.61 21.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.292 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.075 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.1 mm? -69.92 170.31 11.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.639 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.5 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -28.5 -36.29 0.01 OUTLIER Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.497 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.615 ' O ' HG23 ' B' ' 81' ' ' VAL . 2.5 mt-30 -158.62 44.35 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.921 0.391 . . . . 0.0 110.694 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.841 HG13 ' O ' ' B' ' 59' ' ' GLY . 37.7 t -160.02 169.36 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.036 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.606 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -135.88 111.13 9.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.344 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.781 ' HB ' ' CZ ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -98.64 133.61 40.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.157 0.503 . . . . 0.0 112.012 -179.191 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 1.06 HD23 HG13 ' B' ' 57' ' ' ILE . 0.4 OUTLIER -118.85 94.39 4.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.768 179.423 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.765 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 0.5 OUTLIER -98.24 135.7 39.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -179.031 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.727 ' O ' ' HB2' ' B' ' 55' ' ' HIS . 9.3 p90 -174.43 121.03 0.26 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.84 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.789 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -90.49 161.51 15.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 110.923 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.717 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -117.76 21.23 13.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.338 0.59 . . . . 0.0 110.486 179.774 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.151 0 CA-C-O 118.325 -1.264 . . . . 0.0 112.504 -179.806 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.8 0.333 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.975 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.41 153.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.75 HG12 ' HE2' ' A' ' 9' ' ' LYS . 92.4 t -118.66 71.12 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.834 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.877 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -35.63 137.02 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.75 ' HE2' HG12 ' A' ' 7' ' ' VAL . 12.0 mmtt -125.82 -11.26 6.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.647 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.56 ' O ' ' HE1' ' A' ' 73' ' ' PHE . 6.7 t-20 -168.52 87.12 0.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.799 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.668 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -121.91 109.42 14.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.911 0.386 . . . . 0.0 111.685 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.64 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 2.7 m-20 -112.23 30.66 6.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.123 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.681 ' HG3' ' H ' ' A' ' 14' ' ' SER . 11.3 ttp -117.89 171.05 8.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.761 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.729 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 m -53.55 134.62 40.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.028 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.655 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 tm-20 -45.99 -68.27 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.93 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -44.49 -27.33 0.44 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.831 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.645 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.79 -50.03 16.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.541 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.973 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -58.72 -26.83 64.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.481 179.738 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 3.4 pt20 -77.85 -45.29 24.74 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.441 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 36.5 m-20 -67.4 -26.53 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.563 178.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.946 ' OG ' HD22 ' A' ' 85' ' ' LEU . 28.8 t -68.0 -52.57 34.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.612 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.837 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 47.5 t -54.5 -47.7 70.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.48 -35.81 72.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.95 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.923 ' SG ' HG23 ' A' ' 42' ' ' ILE . 10.2 t -67.29 -35.4 79.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.986 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.748 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -72.86 -33.99 66.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.603 ' HA ' HD12 ' A' ' 29' ' ' LEU . 2.4 m -69.62 -37.32 76.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.523 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 2.7 mt-30 -61.78 -41.73 98.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.855 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.77 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -79.5 -17.4 54.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.138 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.658 HD12 ' C ' ' A' ' 25' ' ' ALA . 5.5 mt -80.97 -37.01 30.05 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.971 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.21 -26.96 23.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.249 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.523 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -85.07 -23.6 28.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.951 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.601 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -144.29 -161.2 1.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.644 ' C ' HD13 ' A' ' 34' ' ' ILE . 0.3 OUTLIER -166.32 28.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.613 179.86 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.042 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.4 mm -118.39 103.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.665 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.669 ' HA ' HD12 ' A' ' 38' ' ' ILE . 1.0 OUTLIER -26.33 -77.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.012 0.434 . . . . 0.0 110.821 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.529 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -40.36 -42.15 1.51 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.905 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 1.042 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -64.89 -58.75 5.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.913 ' HB ' HG11 ' A' ' 58' ' ' VAL . 3.8 mt -46.82 -48.42 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.997 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.56 -38.86 82.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.867 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.801 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -59.85 -67.71 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.015 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.674 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -50.39 -49.96 52.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.824 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.923 HG23 ' SG ' ' A' ' 24' ' ' CYS . 98.2 mt -49.99 -67.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.167 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.807 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 4.5 tmtt? -51.25 -40.75 59.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.582 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 1.1 tppt? -54.39 -57.37 11.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.015 0.436 . . . . 0.0 110.736 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 49' ' ' LYS . 5.3 mt-10 -54.0 -54.57 37.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.644 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.789 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.7 m-85 -52.23 -46.75 65.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.867 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.807 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.81 -12.54 61.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.292 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.423 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -123.66 13.21 9.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.739 0.304 . . . . 0.0 111.259 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' A' ' 45' ' ' GLU . 6.0 ttmm -129.96 -31.61 1.92 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.189 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.682 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 60.0 m-85 -109.82 -57.23 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.074 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.78 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 1.5 t-20 160.83 114.22 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.433 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.714 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 16.5 Cg_endo -57.16 165.92 4.82 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.355 2.037 . . . . 0.0 112.455 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.717 HG21 HG21 ' B' ' 67' ' ' THR . 1.2 m -108.66 124.89 51.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 122.974 0.509 . . . . 0.0 110.361 -0.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.75 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.5 m95 -96.89 160.84 14.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.607 . . . . 0.0 111.996 -179.329 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.823 ' HD2' ' HA ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -152.43 111.98 3.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.079 179.352 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.926 ' HB2' HD12 ' A' ' 85' ' ' LEU . 13.7 p -120.3 151.61 38.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.033 HD11 HG13 ' B' ' 66' ' ' VAL . 20.8 mm -126.03 118.36 51.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.444 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.997 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.4 p -113.04 124.03 69.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.6 ' O ' ' HB3' ' A' ' 82' ' ' ALA . . . -157.9 173.84 35.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.275 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.5 OUTLIER -137.7 40.05 2.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.678 0.275 . . . . 0.0 111.295 -179.632 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER 167.89 28.8 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.919 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.878 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 15.7 p90 -117.0 -172.32 2.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.163 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.811 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.63 102.49 0.27 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.737 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.967 ' CB ' HD12 ' B' ' 57' ' ' ILE . 63.6 p -84.87 138.22 32.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.063 0.459 . . . . 0.0 111.731 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.823 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 54.8 t80 -153.32 89.63 1.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.034 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.743 HG12 ' N ' ' B' ' 56' ' ' CYS . 6.2 m -135.18 -161.44 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.203 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.869 ' HB ' HG21 ' B' ' 53' ' ' THR . 0.7 OUTLIER -99.88 -161.16 0.85 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.794 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.713 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 20.8 p80 -168.42 122.53 0.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.804 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.545 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -130.83 157.89 41.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.511 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 74.94 -85.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.047 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.538 ' O ' ' HB2' ' A' ' 13' ' ' MET . 28.7 mttt -109.96 14.44 23.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.713 ' O ' ' HB2' ' A' ' 68' ' ' HIS . 6.7 m170 71.64 -86.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.752 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.694 ' HB3' ' HB2' ' A' ' 86' ' ' PHE . 1.8 p90 162.3 -167.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.436 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.973 HG13 ' HB3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -165.39 110.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.994 0.426 . . . . 0.0 111.673 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.749 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -100.39 138.06 37.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.079 179.198 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.972 ' CE1' HD13 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -159.22 132.97 7.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.979 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' A' ' 81' ' ' VAL . 18.7 t80 -98.95 102.37 14.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.798 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.975 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.2 mm? -55.82 170.02 0.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.763 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.89 -33.25 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.661 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.572 ' N ' ' O ' ' A' ' 78' ' ' LEU . 0.4 OUTLIER -160.08 39.84 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 111.094 -179.812 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.616 HG12 ' N ' ' A' ' 82' ' ' ALA . 81.3 t -156.95 165.31 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.746 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.662 ' C ' HD13 ' A' ' 83' ' ' ILE . . . -125.82 140.97 52.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.553 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.662 HD13 ' C ' ' A' ' 82' ' ' ALA . 0.0 OUTLIER -134.18 130.73 54.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.979 0.418 . . . . 0.0 111.446 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.814 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -120.35 97.7 5.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.851 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.946 HD22 ' OG ' ' A' ' 21' ' ' SER . 1.4 mp -99.65 124.34 44.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.61 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.694 ' HB2' ' HB3' ' A' ' 73' ' ' PHE . 3.0 p90 -166.04 140.79 4.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.29 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.823 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 15.8 mtpt -90.24 -147.18 0.19 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.593 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.674 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.386 0.612 . . . . 0.0 110.473 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.59 ' O ' ' HB3' ' B' ' 5' ' ' LYS . 1.9 tpp85 . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.81 0.338 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.59 ' HB3' ' O ' ' B' ' 4' ' ' ARG . 0.7 OUTLIER 79.32 31.04 0.29 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.667 -179.757 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.46 -165.94 1.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.454 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.576 ' N ' ' O ' ' B' ' 77' ' ' TYR . 87.7 t -154.08 75.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.195 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.789 HD12 ' HB3' ' B' ' 76' ' ' PHE . 1.3 mp -34.69 140.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.266 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.475 ' HE3' ' HB3' ' B' ' 77' ' ' TYR . 7.0 mmtp -119.55 -11.32 9.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.769 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.636 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 51.4 t30 -168.7 -94.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.392 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.896 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 80.41 -179.67 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.598 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.4 m-20 177.15 35.26 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.694 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.808 ' H ' ' NE2' ' B' ' 18' ' ' GLN . 19.6 ttp -130.87 167.66 18.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.838 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.591 ' O ' ' HB2' ' B' ' 17' ' ' MET . 0.0 OUTLIER -48.63 131.3 17.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.91 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.474 ' CA ' ' HG2' ' B' ' 18' ' ' GLN . 1.7 mp0 -40.99 -64.92 0.48 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.671 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 1.1 mm-40 -46.32 -35.96 5.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.305 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.779 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 43.9 mmm -68.34 -33.72 74.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.049 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 1.015 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.7 OUTLIER -73.54 -33.74 64.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.137 179.232 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.739 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 13.1 pt20 -78.0 -36.36 48.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.582 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.664 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER -76.53 -31.64 57.76 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.323 178.623 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -67.88 -49.13 63.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.861 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.949 HG23 ' O ' ' B' ' 18' ' ' GLN . 48.6 t -59.47 -42.94 89.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.228 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.739 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 2.2 mt-10 -60.71 -34.33 74.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.079 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 47.1 m -68.85 -38.5 79.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.118 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.799 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -68.98 -28.23 66.43 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.565 ' HA ' HD12 ' B' ' 29' ' ' LEU . 4.2 m -72.05 -37.74 69.63 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.64 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.743 ' O ' ' HD3' ' B' ' 31' ' ' LYS . 44.2 mt-30 -59.14 -45.71 90.24 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.454 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.93 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -75.81 -20.37 58.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.486 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.839 ' CD2' HG21 ' B' ' 81' ' ' VAL . 4.8 mt -76.42 -45.1 33.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.054 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.29 -23.74 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.992 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.743 ' HD3' ' O ' ' B' ' 27' ' ' GLN . 1.3 mttp -84.93 -33.52 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.731 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.632 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -141.03 -175.94 4.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.63 179.857 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -145.97 34.82 1.01 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.892 0.377 . . . . 0.0 110.842 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 1.014 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.5 mm -120.23 103.82 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.084 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.811 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -29.57 -64.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 110.698 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.5 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 11.9 mmmt -50.86 -54.75 21.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.076 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 1.014 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.4 m-20 -54.69 -61.62 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.567 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.93 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 9.9 mt -41.15 -45.64 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.757 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 1.037 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -64.83 -45.59 85.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.721 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.823 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -54.35 -57.09 12.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.949 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.766 ' CE1' ' HB3' ' B' ' 37' ' ' ASP . 0.1 OUTLIER -54.55 -40.47 68.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.97 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.73 HG13 ' O ' ' B' ' 38' ' ' ILE . 49.1 mt -64.5 -68.89 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.67 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -40.56 -43.04 1.8 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.79 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.615 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 3.9 mtpp -62.56 -54.31 41.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 10.4 mt-10 -64.69 -25.1 67.8 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.075 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -76.96 -46.41 24.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.921 0.391 . . . . 0.0 110.882 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.787 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.3 p30 -66.76 -24.68 66.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.477 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.447 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -89.94 -42.34 11.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.057 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -80.27 -14.56 58.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.36 -179.584 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.664 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 43.5 m-85 -131.11 -71.16 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.665 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 0.5 OUTLIER 157.39 118.9 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.787 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 26.6 Cg_endo -61.52 170.14 5.87 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.512 2.141 . . . . 0.0 112.347 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.869 HG21 ' HB ' ' A' ' 67' ' ' THR . 1.9 m -101.91 136.83 41.07 Favored 'General case' 0 C--N 1.343 0.287 0 C-N-CA 123.044 0.538 . . . . 0.0 110.612 0.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.783 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 56.4 m95 -107.92 105.45 15.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.505 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.792 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 5.9 m170 -78.25 93.83 4.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.987 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.3 OUTLIER -108.5 140.62 41.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.357 0.599 . . . . 0.0 112.589 -178.017 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.987 HD13 ' O ' ' B' ' 56' ' ' CYS . 19.1 mm -135.56 103.45 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.913 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.037 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -103.52 125.41 58.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.678 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.745 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.2 -110.62 0.73 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.959 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.685 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 6.9 ptt180 168.74 3.57 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 178.8 29.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.683 0.277 . . . . 0.0 111.461 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.875 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 2.9 p90 -92.96 -167.34 1.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.055 0.455 . . . . 0.0 110.832 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -139.94 86.11 0.21 Allowed Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.833 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.895 ' CA ' HD12 ' A' ' 57' ' ' ILE . 5.8 p -82.33 122.51 28.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.065 0.46 . . . . 0.0 111.32 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.801 ' CD1' ' HA ' ' A' ' 40' ' ' ALA . 46.6 t80 -133.44 83.53 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.426 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 1.033 HG13 HD11 ' A' ' 57' ' ' ILE . 7.5 m -118.85 150.34 21.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.717 HG21 HG21 ' A' ' 53' ' ' THR . 18.4 m -73.18 77.87 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.603 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.465 ' HB2' ' CB ' ' B' ' 73' ' ' PHE . 29.4 p-80 -59.59 169.01 1.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.821 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 178.11 173.54 0.61 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.489 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 1.6 m 75.81 -89.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.789 ' HE2' ' CE1' ' B' ' 72' ' ' HIS . 0.5 OUTLIER 166.53 43.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.789 ' CE1' ' HE2' ' B' ' 71' ' ' LYS . 84.9 m-70 -138.85 31.25 2.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.794 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 7.6 t80 -111.8 79.36 1.21 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.566 179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 1.015 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -102.87 123.88 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.173 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.71 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -111.91 137.02 50.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.344 179.645 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.805 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 8.0 p90 -161.18 168.33 24.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.982 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.652 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 47.1 t80 -133.92 115.49 14.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.96 170.1 11.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.619 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.502 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.09 -48.07 0.05 OUTLIER Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.733 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.453 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -146.45 38.78 1.05 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.877 0.37 . . . . 0.0 110.747 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.839 HG21 ' CD2' ' B' ' 29' ' ' LEU . 76.5 t -152.25 167.67 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.961 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.738 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -134.32 143.18 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.701 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.799 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.3 OUTLIER -135.5 128.9 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.996 0.427 . . . . 0.0 111.212 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.779 ' O ' ' HA ' ' B' ' 56' ' ' CYS . 0.1 OUTLIER -121.15 96.83 5.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.521 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.967 HD12 ' HB3' ' B' ' 56' ' ' CYS . 1.8 mp -100.09 117.86 35.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.953 ' CE2' HG21 ' B' ' 66' ' ' VAL . 1.0 OUTLIER -150.99 126.59 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.923 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.783 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.6 OUTLIER -103.7 152.76 21.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.82 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.792 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -111.16 17.64 20.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.255 0.55 . . . . 0.0 110.628 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 89' ' ' GLY . . . . . 0.471 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.093 0 CA-C-O 118.419 -1.212 . . . . 0.0 112.622 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.921 0.391 . . . . 0.0 110.817 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.62 166.6 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.646 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 7' ' ' VAL . 65.2 t -134.52 71.51 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.767 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.865 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -31.86 152.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.947 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.585 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -142.81 -11.63 0.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.501 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.47 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER 179.63 103.88 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.53 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.674 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -140.02 130.03 24.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.561 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.616 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 27.4 m-20 -121.17 24.15 10.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.304 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.673 ' HG3' ' H ' ' A' ' 14' ' ' SER . 17.0 ttp -104.01 170.47 7.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.794 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.703 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 0.3 OUTLIER -46.82 138.86 5.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.9 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.615 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 24.9 mp0 -50.26 -64.78 0.7 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 6.4 tt0 -58.21 -16.72 14.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.974 0.416 . . . . 0.0 110.097 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.703 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -81.75 -39.15 24.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.669 179.61 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.992 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.16 -37.94 84.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.521 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -75.21 -36.29 61.41 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.532 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 2.1 m-20 -69.5 -35.11 75.23 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.549 178.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.802 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 1.2 t -64.22 -45.37 88.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.728 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.659 HG13 ' HB2' ' A' ' 6' ' ' ALA . 69.5 t -55.97 -51.13 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.327 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -56.93 -34.18 67.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.588 ' HB3' HG23 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -68.88 -34.35 75.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.694 179.131 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.822 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -72.33 -38.39 68.65 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.504 ' HA ' HD12 ' A' ' 29' ' ' LEU . 34.2 m -67.3 -38.06 84.4 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.711 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.786 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -58.65 -44.31 90.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.512 178.916 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.863 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -72.57 -26.69 61.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.698 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.822 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.6 mt -74.19 -35.82 63.99 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.851 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.94 -28.82 49.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.399 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.786 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 25.5 mmtt -85.2 -33.71 22.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.209 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.589 ' CE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.4 140.8 16.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.503 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -104.75 29.95 5.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.742 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 39.7 mm -104.92 110.22 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.063 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.56 ' HA ' HD12 ' A' ' 38' ' ' ILE . 7.3 mp0 -27.5 -85.83 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.025 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.488 ' HG3' HG22 ' A' ' 34' ' ' ILE . 2.0 pttt -39.13 -34.45 0.17 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.904 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.742 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 49.2 t0 -66.37 -50.88 62.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.069 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.95 HG22 HD11 ' A' ' 42' ' ' ILE . 5.7 mt -58.84 -43.68 88.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 1.012 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -60.23 -39.58 87.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.705 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.797 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -65.55 -63.29 1.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.863 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -42.77 -62.54 0.98 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.478 179.531 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.95 HD11 HG22 ' A' ' 38' ' ' ILE . 16.4 mt -45.42 -66.15 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.356 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.658 ' HB3' ' CE2' ' B' ' 65' ' ' TYR . 0.6 OUTLIER -42.25 -66.23 0.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.938 -179.813 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.537 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 5.0 tptp -36.61 -54.09 0.88 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.672 ' OE1' ' HA ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -57.88 -68.82 0.21 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.728 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.802 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.3 m-85 -37.63 -53.31 1.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.94 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.691 ' OD1' ' HG3' ' A' ' 52' ' ' PRO . 4.5 t70 -54.97 -37.32 66.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.868 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -104.88 11.96 33.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 179.85 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 2.8 mmmt -131.12 11.58 5.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.279 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.611 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 77.8 m-85 -157.58 -63.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.63 0.253 . . . . 0.0 111.487 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 2.5 t30 164.17 107.87 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.58 -179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.691 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 82.5 Cg_exo -47.27 152.23 2.32 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.37 2.046 . . . . 0.0 112.43 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . 1.014 HG21 HG21 ' B' ' 67' ' ' THR . 91.0 m -117.88 133.31 56.05 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 123.08 0.552 . . . . 0.0 110.557 -0.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.837 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.5 m95 -97.44 143.93 27.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.173 0.511 . . . . 0.0 111.784 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.757 ' HB3' ' CB ' ' B' ' 66' ' ' VAL . 1.4 m-70 -131.93 112.76 12.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.278 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.975 ' HB2' HD12 ' A' ' 85' ' ' LEU . 4.4 p -124.84 154.35 41.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.37 0.605 . . . . 0.0 112.596 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.113 HG21 HG21 ' B' ' 57' ' ' ILE . 12.3 mm -131.15 113.22 23.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.234 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.012 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.5 p -105.02 128.99 58.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.019 0.437 . . . . 0.0 111.184 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.736 ' HA3' ' CD1' ' A' ' 62' ' ' PHE . . . -157.99 170.13 34.8 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.995 -0.621 . . . . 0.0 111.783 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.536 ' HB3' ' HA ' ' A' ' 81' ' ' VAL . 0.0 OUTLIER -132.84 34.82 3.6 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.956 0.408 . . . . 0.0 110.887 -179.792 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 1.1 t-20 169.63 27.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.68 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.982 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 20.7 p90 -115.52 -169.83 1.65 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.906 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.35 95.6 0.17 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.916 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.976 ' CB ' HD12 ' B' ' 57' ' ' ILE . 20.0 p -80.99 140.5 35.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.979 0.419 . . . . 0.0 111.539 -179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.825 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 71.8 t80 -149.13 93.23 2.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.283 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.947 HG21 ' CD2' ' A' ' 86' ' ' PHE . 4.1 m -133.1 149.35 31.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.702 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.929 HG21 HG21 ' B' ' 53' ' ' THR . 1.6 t -79.58 147.31 32.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.679 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 1.044 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -100.92 155.03 18.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.22 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.664 ' HG3' ' OG ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -129.65 -82.48 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.045 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.551 ' C ' ' H ' ' A' ' 72' ' ' HIS . 36.2 m -66.0 -107.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.941 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.586 ' HG3' ' HG3' ' A' ' 13' ' ' MET . 0.0 OUTLIER -69.87 31.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.9 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 1.044 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 1.1 m80 56.61 -91.36 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.636 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.78 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 161.59 -174.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.718 179.756 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.992 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -154.92 131.76 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.265 -179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.538 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 2.3 t80 -120.61 133.39 55.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.071 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.865 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -151.66 164.73 36.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.94 0.4 . . . . 0.0 111.113 -179.516 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.601 ' O ' ' HD1' ' A' ' 77' ' ' TYR . 4.0 t80 -122.92 92.53 3.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.964 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.8 mm? -48.12 166.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.692 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -24.47 -54.93 0.05 OUTLIER Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.99 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.72 12.15 3.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.693 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.843 HG12 ' H ' ' A' ' 82' ' ' ALA . 21.8 t -129.58 179.64 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.502 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.843 ' H ' HG12 ' A' ' 81' ' ' VAL . . . -141.19 143.51 34.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.726 0.298 . . . . 0.0 110.67 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.783 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -130.96 125.78 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.739 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.91 HD23 HG12 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -113.12 96.98 6.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.115 179.51 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.975 HD12 ' HB2' ' A' ' 56' ' ' CYS . 1.7 mp -95.6 128.89 42.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.892 0.377 . . . . 0.0 111.494 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.947 ' CD2' HG21 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -159.84 119.67 2.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.989 179.493 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.837 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -111.69 149.67 31.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.047 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.664 ' OG ' ' HG3' ' A' ' 69' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 121.326 0.584 . . . . 0.0 110.587 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.407 ' HD3' HH11 ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.783 0.325 . . . . 0.0 111.038 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.642 ' O ' ' HB2' ' B' ' 6' ' ' ALA . 0.0 OUTLIER -47.74 118.51 2.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.763 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.936 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.67 -179.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.765 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.705 HG23 ' O ' ' B' ' 77' ' ' TYR . 41.2 t -145.06 63.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.921 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.5 OUTLIER -33.49 148.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.442 -179.845 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.588 ' HG2' ' O ' ' B' ' 8' ' ' ILE . 13.9 mmtt -148.21 -1.86 0.54 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.929 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.483 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 10.3 t-20 -175.22 83.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.761 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.752 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -123.7 113.51 18.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.831 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.901 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 94.7 m-20 -110.65 37.7 2.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.984 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 17' ' ' MET . 17.3 ttp -125.68 170.97 11.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.075 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.712 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.44 141.84 14.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.827 179.877 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.661 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 17.7 mp0 -50.89 -60.53 2.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.896 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 1.3 mt-10 -54.24 -20.73 7.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.536 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -82.67 -34.57 27.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.866 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 1.036 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.69 -36.97 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.823 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.763 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 10.4 mp0 -77.06 -40.72 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.519 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 5.0 m-20 -67.05 -34.01 76.77 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.468 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.853 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -65.5 -46.65 78.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.034 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.845 HG22 ' CD2' ' B' ' 76' ' ' PHE . 73.3 t -56.28 -42.38 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.242 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.763 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 24.1 mt-10 -60.6 -39.4 87.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.333 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.539 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 4.1 t -66.51 -32.97 74.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 110.097 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.78 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -73.22 -32.15 64.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.977 ' HA ' HD12 ' B' ' 29' ' ' LEU . 90.1 m -72.43 -39.53 67.78 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.312 -1.313 . . . . 0.0 109.639 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.789 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 80.7 mm-40 -58.11 -46.1 86.13 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.315 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.997 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -67.93 -29.09 68.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.843 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.988 HD11 ' HG ' ' B' ' 78' ' ' LEU . 4.5 mt -65.36 -57.11 9.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.664 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -34.48 71.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.803 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.789 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 16.0 mmtt -79.83 -28.78 40.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.676 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.552 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -167.56 133.63 2.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.183 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -97.47 26.25 5.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.564 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 1.019 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 10.3 mm -95.84 109.98 23.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.743 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.906 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 0.5 OUTLIER -29.73 -70.37 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.116 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.616 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -50.67 -56.52 11.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.916 0.388 . . . . 0.0 110.557 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 1.019 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -43.99 -64.17 0.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.541 179.806 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.997 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 7.0 mt -45.49 -52.96 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.671 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.911 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -51.4 -39.16 56.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.825 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -66.89 -63.38 1.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.573 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.672 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.5 OUTLIER -42.84 -47.34 5.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.518 179.672 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.78 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 32.5 mt -61.74 -70.44 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.393 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.766 ' HB3' ' CE2' ' A' ' 65' ' ' TYR . 0.5 OUTLIER -36.49 -58.98 0.68 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.478 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 1.6 tttm -51.38 -42.28 61.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.54 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.771 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -70.45 -42.25 71.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.358 -179.458 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.853 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -63.56 -35.78 81.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.014 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.801 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -68.84 -46.43 68.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.698 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.4 ' N ' ' CG ' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -78.16 -25.49 47.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.219 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.771 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -89.7 -16.9 29.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.122 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.749 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 53.6 m-85 -125.93 -72.01 0.67 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.455 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.749 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 52.7 t30 160.09 108.55 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.801 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 62.4 Cg_exo -35.02 157.23 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.562 2.174 . . . . 0.0 112.63 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.929 HG21 HG21 ' A' ' 67' ' ' THR . 0.3 OUTLIER -121.92 120.13 33.56 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 122.809 0.444 . . . . 0.0 110.611 -0.005 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.836 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 33.8 m95 -88.69 155.29 19.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.278 0.561 . . . . 0.0 111.491 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.781 ' CD2' ' CZ ' ' A' ' 86' ' ' PHE . 1.6 m80 -136.03 99.11 4.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.265 -0.88 . . . . 0.0 108.888 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.998 ' O ' HD13 ' B' ' 57' ' ' ILE . 2.3 m -108.08 151.51 25.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 1.113 HG21 HG21 ' A' ' 57' ' ' ILE . 18.1 mm -135.46 108.15 8.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.629 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 0.911 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.1 p -111.1 125.78 68.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -178.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.894 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -146.63 -96.1 0.18 Allowed Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.196 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.627 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 16.5 ptt85 169.27 -27.82 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 120.813 0.339 . . . . 0.0 111.088 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.615 ' O ' ' ND2' ' B' ' 61' ' ' ASN . 0.2 OUTLIER -160.47 42.41 0.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.982 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.6 p90 -96.65 -165.02 1.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.875 0.369 . . . . 0.0 110.784 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.522 ' HA3' ' HB3' ' A' ' 35' ' ' GLU . . . -141.08 111.57 0.72 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.795 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.955 ' CA ' HD12 ' A' ' 57' ' ' ILE . 88.4 p -101.1 128.32 47.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.084 0.469 . . . . 0.0 111.596 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.797 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 48.0 t80 -136.41 67.62 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.143 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.861 HG13 HD11 ' A' ' 57' ' ' ILE . 10.3 m -103.28 169.86 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.376 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 67' ' ' THR . . . . . 1.014 HG21 HG21 ' A' ' 53' ' ' THR . 59.6 m -117.34 80.64 1.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.71 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.834 ' HE1' ' HB ' ' B' ' 70' ' ' THR . 59.7 t-80 -57.37 -129.19 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.945 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.574 ' N ' ' ND1' ' B' ' 68' ' ' HIS . 6.7 pt-20 161.32 -47.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.027 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.834 ' HB ' ' HE1' ' B' ' 68' ' ' HIS . 4.0 m -87.73 -111.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.613 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.584 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -56.97 4.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.66 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.901 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 0.1 OUTLIER 72.4 -74.77 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.64 0.257 . . . . 0.0 110.549 -179.879 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.767 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 4.3 p90 154.94 173.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.215 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 1.036 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -147.17 119.28 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.922 0.391 . . . . 0.0 111.246 179.511 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.764 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 1.4 t80 -103.79 136.55 43.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.351 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.921 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.38 129.19 5.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.975 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.705 ' O ' HG23 ' B' ' 7' ' ' VAL . 2.4 t80 -97.16 113.38 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 0.988 ' HG ' HD11 ' B' ' 29' ' ' LEU . 0.9 OUTLIER -69.47 170.54 10.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.42 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.506 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.54 -41.55 0.01 OUTLIER Glycine 0 C--N 1.33 0.242 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.958 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.521 ' N ' ' O ' ' B' ' 78' ' ' LEU . 51.6 mt-30 -154.02 35.4 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.894 HG13 ' O ' ' B' ' 59' ' ' GLY . 58.6 t -151.16 170.91 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.024 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.942 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.61 154.13 46.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.299 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.942 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -142.71 126.57 14.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.418 . . . . 0.0 111.56 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 1.04 HD23 HG12 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -118.57 95.71 4.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.201 179.439 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.936 HD12 ' HB3' ' B' ' 56' ' ' CYS . 1.7 mp -93.65 123.74 37.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.368 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.756 ' CD1' HG21 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -162.53 123.23 2.48 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.558 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.836 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 2.2 ptmt -100.59 143.78 30.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.956 0.407 . . . . 0.0 110.974 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.598 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -107.23 18.92 21.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.321 0.581 . . . . 0.0 110.48 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.4 -1.222 . . . . 0.0 112.431 -179.946 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 6' ' ' ALA . 8.1 mmmm . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.743 0.306 . . . . 0.0 110.652 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.081 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 56.72 144.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.216 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.506 HG12 ' HE2' ' A' ' 9' ' ' LYS . 21.4 t -107.69 78.29 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.969 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.995 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -46.38 154.42 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.051 0.453 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.506 ' HE2' HG12 ' A' ' 7' ' ' VAL . 5.6 mmtt -138.53 -19.4 1.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.27 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -168.27 98.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.535 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.735 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -112.13 75.47 0.92 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.748 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.757 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 7.4 m-20 -75.17 38.54 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.251 0.548 . . . . 0.0 109.618 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.871 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -136.26 172.12 13.47 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.626 -179.113 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.871 ' N ' ' HG2' ' A' ' 13' ' ' MET . 8.3 t -54.24 134.74 44.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.285 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.829 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.0 OUTLIER -51.36 -78.95 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.337 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.497 ' HG2' ' N ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -43.33 -27.42 0.25 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.979 0.419 . . . . 0.0 110.352 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.835 ' HG2' ' CG ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -78.71 -35.06 45.45 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.047 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.829 HE21 ' HA ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -74.58 -31.62 62.12 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.818 0.342 . . . . 0.0 110.398 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -72.28 -40.9 67.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -66.65 -29.67 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.529 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.727 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -66.58 -45.61 78.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.049 179.081 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.764 HG22 ' CD2' ' A' ' 76' ' ' PHE . 84.7 t -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.477 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -58.15 -36.84 73.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.953 0.406 . . . . 0.0 110.081 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.8 t -67.37 -32.68 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.047 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.766 ' C ' HD12 ' A' ' 29' ' ' LEU . . . -73.56 -40.27 64.06 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.874 ' HA ' HD12 ' A' ' 29' ' ' LEU . 87.1 m -64.55 -37.71 88.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.271 -1.332 . . . . 0.0 109.43 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -61.26 -43.09 99.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.493 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.795 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -76.69 -14.5 59.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.996 179.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.874 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.4 mt -82.53 -44.99 15.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.777 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -34.51 64.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.241 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 3.1 mttm -79.13 -28.65 42.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.649 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.636 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.68 149.07 27.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.94 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -116.37 33.53 5.5 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.053 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.976 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 5.7 mm -112.95 107.86 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.964 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.916 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 35.5 mp0 -29.95 -74.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.904 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.505 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -43.54 -59.46 2.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.691 179.767 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.976 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -45.2 -63.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.544 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.795 HG23 ' CB ' ' A' ' 28' ' ' ALA . 7.5 mt -46.79 -52.22 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.126 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 1.076 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -54.16 -36.7 63.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.101 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.805 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -66.23 -67.28 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.115 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.689 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -46.14 -39.93 10.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.754 HG13 ' O ' ' A' ' 38' ' ' ILE . 65.6 mt -62.8 -66.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.966 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.892 ' HE3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -46.61 -47.05 20.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 47' ' ' ASP . 0.8 OUTLIER -52.85 -63.47 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.677 ' OE1' ' HA ' ' A' ' 45' ' ' GLU . 4.5 tp10 -45.61 -58.02 3.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.378 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.727 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 2.1 m-85 -52.93 -39.72 63.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.594 179.634 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.799 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 3.9 t70 -62.12 -24.96 67.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.345 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.805 ' HE3' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -118.4 4.76 11.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.799 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.625 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -107.74 -14.22 14.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.938 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.797 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 5.6 m-85 -145.51 -63.14 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.24 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.797 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 10.7 p-10 157.0 117.16 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.148 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.799 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 13.8 Cg_endo -56.18 174.82 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.47 2.113 . . . . 0.0 112.22 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 23.4 m -103.66 123.16 46.48 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.14 0.576 . . . . 0.0 110.577 0.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.817 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 51.5 m95 -96.77 126.95 42.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.18 0.514 . . . . 0.0 112.181 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.749 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -106.82 96.99 6.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.504 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.939 ' O ' HD13 ' A' ' 57' ' ' ILE . 18.9 p -111.4 147.08 35.99 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.199 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.963 ' CG1' HD23 ' A' ' 84' ' ' LEU . 18.3 mm -133.03 109.67 14.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.304 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.076 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.1 p -109.42 124.62 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 111.796 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.84 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -146.65 -135.76 2.78 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.061 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -160.89 -20.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.749 0.309 . . . . 0.0 111.312 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.708 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 8.8 m-20 -154.91 35.37 0.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.355 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.917 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 11.2 p90 -101.66 -178.29 3.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.71 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.815 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.73 107.59 0.61 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.82 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.889 ' CB ' HD12 ' B' ' 57' ' ' ILE . 53.6 p -92.41 130.37 38.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.207 0.527 . . . . 0.0 111.713 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.808 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 48.5 t80 -136.67 72.06 1.42 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.099 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.046 HG13 HD11 ' B' ' 57' ' ' ILE . 5.9 m -122.38 136.53 58.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.294 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' THR . . . . . 1.055 HG21 HG21 ' B' ' 53' ' ' THR . 7.0 t -67.94 116.78 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.972 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.46 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 21.4 p-80 -87.21 162.83 17.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.736 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.517 ' O ' HG23 ' A' ' 70' ' ' THR . 6.3 pt-20 -158.57 -153.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.949 0.404 . . . . 0.0 111.166 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.517 HG23 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 44.06 -92.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.772 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 170.64 21.02 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.659 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.851 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 31.3 m170 -125.18 61.96 1.18 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.12 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.757 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 7.4 t80 -130.76 97.82 4.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.933 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.926 HG23 ' HE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -115.42 122.88 70.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.804 -179.163 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.593 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 8.0 t80 -114.04 137.11 52.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.299 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.995 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -161.0 173.23 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.183 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.706 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 89.2 t80 -132.87 92.47 3.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.908 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.081 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.1 mm? -42.75 169.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.59 -44.14 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.424 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.567 ' O ' ' NE2' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -148.37 32.62 0.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.84 HG13 ' O ' ' A' ' 59' ' ' GLY . 76.4 t -147.46 171.66 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.65 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.711 ' C ' HD13 ' A' ' 83' ' ' ILE . . . -133.51 144.79 49.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.82 0.343 . . . . 0.0 110.745 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.711 HD13 ' C ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -134.53 124.64 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.077 -179.752 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.963 HD23 ' CG1' ' A' ' 57' ' ' ILE . 0.9 OUTLIER -112.72 88.34 2.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.556 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.79 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -93.35 124.19 37.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.472 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CE1' ' HB2' ' A' ' 55' ' ' HIS . 2.5 p90 -164.11 129.04 2.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.591 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.798 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.53 161.59 13.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.503 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.668 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 0.0 110.434 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.558 HH11 ' CB ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.735 0.302 . . . . 0.0 110.682 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.529 ' HD2' ' O ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER -112.02 40.52 2.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.088 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -115.42 -170.92 1.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.336 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.782 HG12 ' HE3' ' B' ' 9' ' ' LYS . 26.8 t -137.98 66.69 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.801 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.9 OUTLIER -37.21 157.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.132 0.491 . . . . 0.0 110.663 -179.829 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.782 ' HE3' HG12 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -154.44 -11.4 0.13 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.201 179.722 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.519 ' O ' ' N ' ' B' ' 75' ' ' TYR . 3.9 t-20 -166.8 100.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.433 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.692 ' HB1' ' OE1' ' B' ' 18' ' ' GLN . . . -128.77 136.77 50.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.019 0.438 . . . . 0.0 111.599 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.572 ' CB ' ' HD2' ' B' ' 68' ' ' HIS . 21.1 t70 -132.63 28.7 4.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.774 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.824 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 13.5 ttp -123.98 151.58 43.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.856 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.783 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 2.1 m -36.52 141.39 0.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.942 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.692 ' HA ' HE21 ' B' ' 18' ' ' GLN . 11.9 mt-10 -46.94 -66.45 0.4 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.184 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.706 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -50.93 -30.57 15.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.773 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.796 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.13 -40.75 74.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.743 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.817 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -66.78 -28.67 68.58 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.849 0.357 . . . . 0.0 110.469 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.706 ' HG2' ' O ' ' B' ' 16' ' ' GLU . 2.6 pt20 -77.36 -42.55 36.08 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.625 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 1.1 m-20 -69.9 -25.03 63.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.79 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.827 ' OG ' HG21 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -70.87 -51.52 25.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.196 179.278 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.818 ' HA ' ' CZ ' ' B' ' 76' ' ' PHE . 60.9 t -57.17 -42.39 79.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.244 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 8.7 mt-10 -61.42 -38.88 88.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.077 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.421 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 65.9 m -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.964 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.76 ' C ' HD12 ' B' ' 29' ' ' LEU . . . -70.23 -33.63 71.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.581 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 1.4 m -66.84 -40.76 88.05 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.43 -1.259 . . . . 0.0 109.487 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 33.0 mt-30 -56.57 -44.92 81.46 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.562 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.729 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -80.25 -15.23 57.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.565 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.886 HD21 HG11 ' B' ' 81' ' ' VAL . 5.7 mt -82.57 -35.71 26.9 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' GLU . . . . . 0.641 ' OE1' ' HD2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -88.07 -30.19 20.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.188 -179.717 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.641 ' HD2' ' OE1' ' B' ' 30' ' ' GLU . 1.7 mptt -84.39 -9.75 58.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.834 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.611 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.1 OUTLIER -151.1 -150.09 0.33 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.975 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 1.1 t30 177.87 28.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.609 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 1.037 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.8 mm -117.8 106.4 19.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.509 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.815 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 2.3 mp0 -29.67 -62.65 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.924 0.392 . . . . 0.0 110.731 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.626 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -55.1 -51.97 64.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.017 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 1.037 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.5 m-20 -54.44 -61.3 2.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.828 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.875 ' HB ' HG11 ' B' ' 58' ' ' VAL . 2.5 mt -45.78 -48.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.008 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 1.034 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -62.42 -34.2 76.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.808 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -62.4 -62.91 1.43 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.034 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.608 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -53.72 -54.13 42.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.939 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.765 HD11 HG22 ' B' ' 38' ' ' ILE . 73.7 mt -44.06 -66.65 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.277 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.712 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 13.2 tttp -42.82 -50.97 5.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.903 0.382 . . . . 0.0 110.917 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.529 ' HZ2' ' HB3' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -55.9 -45.9 78.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.219 -179.79 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.686 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.0 mt-10 -68.09 -34.88 77.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.15 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.788 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -72.32 -32.63 66.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.991 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.733 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 5.1 m-20 -71.31 -38.0 71.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.915 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.48 -23.67 20.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.688 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.686 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.4 OUTLIER -86.03 -20.53 28.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.359 -179.562 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.555 ' HD2' ' O ' ' B' ' 46' ' ' PHE . 12.7 m-85 -132.09 -66.82 0.69 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.617 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.492 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 7.6 t30 158.93 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.395 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.733 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 20.8 Cg_endo -60.3 171.61 3.11 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.307 2.005 . . . . 0.0 112.333 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' THR . . . . . 1.055 HG21 HG21 ' A' ' 67' ' ' THR . 62.9 m -104.74 131.57 52.02 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 122.917 0.487 . . . . 0.0 111.052 0.115 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.826 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 46.2 m95 -102.2 157.58 16.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.591 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.771 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 10.2 m-70 -128.91 99.57 5.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.755 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.665 ' O ' HD13 ' B' ' 57' ' ' ILE . 1.8 m -106.26 128.26 53.84 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 1.046 HD11 HG13 ' A' ' 66' ' ' VAL . 17.0 mm -125.32 101.38 8.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.501 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.034 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.7 p -108.77 126.24 65.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 0.0 111.85 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.771 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -144.08 -105.29 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.795 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.661 ' HE ' ' HB3' ' A' ' 61' ' ' ASN . 0.4 OUTLIER 170.91 -33.26 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.67 0.271 . . . . 0.0 111.194 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.46 ' O ' ' OE2' ' A' ' 35' ' ' GLU . 10.0 m120 -145.02 46.72 1.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.125 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.917 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 21.3 p90 -111.0 -173.54 2.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.904 0.383 . . . . 0.0 110.76 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.916 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -138.0 98.53 0.26 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.778 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.916 ' CA ' HD12 ' A' ' 57' ' ' ILE . 1.2 p -86.81 121.99 30.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.223 0.535 . . . . 0.0 111.591 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.892 ' HE2' ' HE3' ' A' ' 43' ' ' LYS . 21.8 t80 -129.14 75.53 1.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.791 HG13 HD11 ' A' ' 57' ' ' ILE . 28.4 m -123.48 164.62 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.336 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.593 HG21 HG21 ' A' ' 53' ' ' THR . 5.3 t -82.91 128.17 34.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.669 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.572 ' HD2' ' CB ' ' B' ' 12' ' ' ASP . 1.8 p-80 -104.11 118.57 36.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.557 ' O ' ' HB ' ' B' ' 70' ' ' THR . 0.8 OUTLIER -123.29 168.73 12.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.707 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.557 ' HB ' ' O ' ' B' ' 69' ' ' GLU . 29.0 m 76.13 -100.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.716 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.631 ' O ' ' HA ' ' B' ' 13' ' ' MET . 2.3 ttpt 173.33 38.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.798 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.826 ' HB3' ' CZ3' ' B' ' 54' ' ' TRP . 2.2 m80 -138.66 46.87 1.97 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.794 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 4.8 t80 -120.69 87.67 2.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.404 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.827 HG21 ' OG ' ' B' ' 21' ' ' SER . 1.2 tt -105.48 144.91 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.045 0.45 . . . . 0.0 111.632 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.8 OUTLIER -134.1 131.18 38.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.195 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.818 ' CZ ' ' HA ' ' B' ' 22' ' ' VAL . 9.7 p90 -158.54 161.7 37.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.991 0.425 . . . . 0.0 111.258 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.737 ' O ' HG23 ' B' ' 7' ' ' VAL . 8.0 t80 -122.23 111.02 16.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.411 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.088 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.41 169.97 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.767 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -23.39 -45.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 113.15 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.581 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 14.3 tt0 -151.4 36.74 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.752 0.311 . . . . 0.0 110.937 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.886 HG11 HD21 ' B' ' 29' ' ' LEU . 86.0 t -152.12 170.18 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.184 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.824 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -133.85 149.94 51.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.824 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -140.11 131.56 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.188 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.982 HD23 ' CG1' ' B' ' 57' ' ' ILE . 2.0 tp -121.34 88.58 2.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.794 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 1.3 mp -92.93 124.54 36.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.069 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.783 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 12.1 p90 -162.72 132.83 4.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.349 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.799 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -93.82 151.87 19.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.534 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.687 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.1 OUTLIER -113.99 19.72 16.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.314 0.578 . . . . 0.0 110.17 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.397 -1.224 . . . . 0.0 112.436 -179.866 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.414 ' O ' HD13 ' A' ' 78' ' ' LEU . 6.1 tptm . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.877 0.37 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.043 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -136.5 175.3 9.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.212 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.522 ' O ' ' HE3' ' A' ' 9' ' ' LYS . 95.9 t -137.31 77.94 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.758 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.808 HD12 ' HB3' ' A' ' 76' ' ' PHE . 1.2 mp -32.78 148.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.334 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.774 ' HB2' ' CD2' ' A' ' 75' ' ' TYR . 5.0 mmtp -129.45 -14.19 4.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.847 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 1.7 t30 -164.09 -91.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.483 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.993 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 70.09 -173.96 0.18 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.577 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.617 ' HB3' ' HB3' ' A' ' 72' ' ' HIS . 2.8 t0 166.62 28.51 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.471 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.648 ' HG2' ' CB ' ' A' ' 17' ' ' MET . 15.4 ttp -113.76 171.58 7.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.674 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.901 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 1.9 m -48.35 129.17 15.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.877 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.501 ' H ' ' HG2' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -34.39 -79.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.795 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.64 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 2.1 mm-40 -46.07 -22.89 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.901 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -76.14 -39.89 53.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.549 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.835 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -68.47 -38.16 80.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.495 179.625 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.443 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 1.0 OUTLIER -72.98 -36.74 67.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.566 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.64 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.4 t0 -66.78 -39.58 87.86 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.84 179.233 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.985 ' HB2' HD22 ' A' ' 85' ' ' LEU . 1.1 p -60.35 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.74 178.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.809 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 40.1 t -52.74 -50.24 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.303 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 54.2 mt-10 -54.3 -46.78 72.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.22 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.434 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 20.0 m -59.29 -37.31 77.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.034 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.774 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.04 -28.32 66.45 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.8 m -72.93 -39.43 66.28 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.4 -1.273 . . . . 0.0 109.54 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.699 ' O ' ' HD3' ' A' ' 31' ' ' LYS . 15.4 mm100 -56.79 -43.22 80.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.406 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.966 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -75.99 -29.94 58.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.178 179.039 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 1.074 HD21 HG11 ' A' ' 81' ' ' VAL . 3.1 mt -72.71 -30.52 64.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.212 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -95.96 -16.11 21.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.831 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.699 ' HD3' ' O ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -92.5 -23.93 18.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.554 ' HE1' ' HA ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -163.49 134.84 4.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.754 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -96.11 39.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.894 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.713 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 40.2 mm -117.59 102.16 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.001 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.653 ' OE2' ' HD3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -22.25 -89.43 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.423 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -37.03 -42.88 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.727 179.967 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.713 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 24.2 t0 -57.96 -56.54 20.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.517 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.966 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.8 mt -52.04 -45.72 41.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.838 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -61.87 -45.72 92.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.802 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -56.2 -64.34 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.286 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.909 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -38.8 -52.68 1.72 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.02 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.902 HG21 HD11 ' A' ' 85' ' ' LEU . 16.9 mt -55.91 -68.17 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.203 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.61 ' C ' ' HE2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -37.34 -63.03 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.204 -179.848 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -43.92 -57.19 3.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.418 . . . . 0.0 111.037 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.586 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -53.51 -57.03 12.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.205 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.797 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -55.03 -34.82 63.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.554 ' HB2' ' CE ' ' A' ' 43' ' ' LYS . 17.6 t70 -73.54 -20.88 60.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.57 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.74 ' HE3' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -121.38 10.53 10.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.586 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.8 OUTLIER -128.18 3.35 5.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.547 -179.431 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.58 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 95.7 m-85 -147.07 -63.12 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.497 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 18.8 p-10 161.56 110.87 0.01 OUTLIER Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.109 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.483 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 86.1 Cg_exo -45.96 151.06 1.55 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.311 2.008 . . . . 0.0 112.578 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.684 HG21 HG21 ' B' ' 67' ' ' THR . 95.1 m -118.74 136.17 54.11 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.162 0.585 . . . . 0.0 110.353 -0.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.809 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 65.3 m95 -101.48 144.8 29.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.27 0.557 . . . . 0.0 111.993 -179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.926 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 0.0 OUTLIER -130.26 103.39 6.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.847 178.854 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.851 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.37 162.64 18.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.404 0.621 . . . . 0.0 112.496 -178.176 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.993 HD12 ' HA ' ' B' ' 64' ' ' SER . 26.2 mm -131.77 172.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.977 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.937 HG11 ' HB ' ' A' ' 38' ' ' ILE . 7.3 p -169.33 114.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.946 0.403 . . . . 0.0 111.563 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.569 ' HA2' ' CG ' ' A' ' 35' ' ' GLU . . . -141.07 -140.06 3.78 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.801 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.653 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -162.78 6.09 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.427 ' O ' ' OE2' ' B' ' 35' ' ' GLU . 0.6 OUTLIER -179.99 32.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.76 0.314 . . . . 0.0 111.205 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.955 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -101.12 -169.1 1.65 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.097 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.606 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.41 93.98 0.17 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.849 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.783 ' HB3' HD13 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -82.72 134.15 35.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 0.0 111.498 -179.244 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.761 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 19.7 t80 -143.34 65.29 1.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.256 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.813 HG21 ' CE2' ' A' ' 86' ' ' PHE . 2.8 m -113.94 153.7 15.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.357 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.607 HG22 ' CE1' ' B' ' 55' ' ' HIS . 3.4 t -62.57 -162.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.951 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.621 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -156.85 150.16 24.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.915 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.733 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -143.48 175.03 10.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 179.894 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 72' ' ' HIS . 3.5 m 42.37 -114.57 0.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.662 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.857 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 4.2 mmtm -69.87 24.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.762 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 51.1 m-70 62.54 -88.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.69 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.762 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 0.2 OUTLIER 162.58 -169.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.604 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.993 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -161.12 141.37 3.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.443 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.774 ' CD2' ' HB2' ' A' ' 9' ' ' LYS . 7.8 t80 -131.54 139.47 49.25 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.787 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.809 ' CE2' ' HA ' ' A' ' 22' ' ' VAL . 0.2 OUTLIER -161.55 176.42 11.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.845 0.355 . . . . 0.0 111.097 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.751 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 42.4 t80 -135.48 97.21 3.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.201 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.043 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -60.3 -169.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.457 179.695 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.565 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -61.73 93.08 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.07 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.565 ' HB2' ' O ' ' A' ' 79' ' ' GLY . 30.0 mm-40 71.1 15.9 6.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.117 0.484 . . . . 0.0 110.268 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 1.074 HG11 HD21 ' A' ' 29' ' ' LEU . 55.2 t -136.84 164.91 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.775 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.814 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -138.37 151.87 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.69 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.874 ' CD1' HG23 ' A' ' 58' ' ' VAL . 0.2 OUTLIER -140.41 126.42 21.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.884 0.374 . . . . 0.0 111.398 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.9 HD23 HG12 ' A' ' 57' ' ' ILE . 0.9 OUTLIER -112.02 93.37 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.985 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -92.21 147.44 22.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.173 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.813 ' CE2' HG21 ' A' ' 66' ' ' VAL . 5.9 p90 179.33 119.02 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.182 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.857 ' HZ3' ' HG2' ' A' ' 71' ' ' LYS . 2.3 ptmt -101.12 150.97 22.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.926 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-O 121.242 0.544 . . . . 0.0 110.911 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.454 ' O ' ' C ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.874 0.368 . . . . 0.0 110.831 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.498 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.6 OUTLIER 32.49 40.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.261 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.049 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -131.78 -176.27 3.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.278 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.557 ' N ' ' O ' ' B' ' 77' ' ' TYR . 45.0 t -145.73 72.41 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.922 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.807 HD12 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -33.15 147.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 110.583 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.546 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 0.5 OUTLIER -134.35 -12.39 2.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.686 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 173.6 103.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.826 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.686 ' HB1' ' HG2' ' B' ' 18' ' ' GLN . . . -130.4 154.12 48.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.454 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.945 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 26.6 m-20 -146.98 27.51 1.06 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.339 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.91 ' SD ' ' HG3' ' B' ' 71' ' ' LYS . 10.7 ttp -108.26 178.02 4.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.598 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.764 ' H ' ' HG3' ' B' ' 13' ' ' MET . 3.5 m -58.76 128.6 38.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.806 0.336 . . . . 0.0 111.015 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.525 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 1.6 mt-10 -33.35 -70.06 0.08 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.747 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 3.4 mm-40 -55.22 -26.51 39.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.272 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.793 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 38.5 mmm -72.56 -34.67 67.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.822 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.96 ' CA ' HD12 ' B' ' 74' ' ' ILE . 4.2 mt-30 -72.41 -48.62 39.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.022 0.439 . . . . 0.0 110.663 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.768 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 14.5 mm-40 -68.3 -23.43 64.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.779 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER -79.11 -34.89 43.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.86 179.166 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.897 ' OG ' HG21 ' B' ' 74' ' ' ILE . 0.2 OUTLIER -65.96 -41.49 91.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.883 179.075 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.887 HG22 ' CD2' ' B' ' 76' ' ' PHE . 95.4 t -63.85 -50.17 78.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.262 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.768 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 39.7 mt-10 -51.94 -40.91 61.56 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.491 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.744 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 48.6 t -66.7 -37.59 85.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.321 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.749 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -69.56 -28.8 66.29 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.618 ' HA ' HD12 ' B' ' 29' ' ' LEU . 4.7 m -70.82 -43.31 68.88 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 114.329 -1.305 . . . . 0.0 109.513 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.744 ' HG3' ' HA ' ' B' ' 24' ' ' CYS . 15.0 mt-30 -53.5 -47.3 69.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.717 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.872 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -76.21 -20.19 57.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.632 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.734 ' CD1' ' HG ' ' B' ' 78' ' ' LEU . 5.9 mt -74.89 -39.89 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.272 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.47 -30.56 27.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.382 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.561 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 7.2 mttt -82.04 -33.34 30.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.0 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.775 ' CE1' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -144.44 157.12 44.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.413 ' C ' HD13 ' B' ' 34' ' ' ILE . 2.9 p30 -123.54 29.36 6.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.214 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 1.094 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 4.0 mm -107.68 108.0 24.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.7 ' O ' HG13 ' B' ' 58' ' ' VAL . 0.3 OUTLIER -29.79 -71.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.132 -179.512 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.52 ' H ' ' HG2' ' B' ' 36' ' ' LYS . 0.5 OUTLIER -50.03 -54.67 18.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.866 0.365 . . . . 0.0 110.647 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 1.094 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.3 m-20 -46.11 -64.65 0.7 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.911 ' HB ' HG11 ' B' ' 58' ' ' VAL . 4.8 mt -44.56 -56.01 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.253 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 1.006 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.88 -38.32 70.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.471 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.761 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -57.59 -58.83 6.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.218 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.775 ' CD2' ' CE1' ' B' ' 32' ' ' TYR . 0.1 OUTLIER -58.07 -33.93 69.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.13 -179.82 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.767 HG13 ' O ' ' B' ' 38' ' ' ILE . 62.5 mt -66.05 -69.51 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.572 ' HB3' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -45.11 -37.28 4.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.962 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.606 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 43.3 mmtt -71.14 -51.67 23.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 111.023 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.505 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.6 mt-10 -62.69 -25.58 68.23 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.947 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.805 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -75.61 -47.49 26.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.617 179.912 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.74 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.9 OUTLIER -64.94 -24.68 67.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.304 179.642 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.716 ' C ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -89.85 -42.76 11.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.625 179.863 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.668 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.8 tttp -83.0 -14.17 54.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.05 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.779 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 58.0 m-85 -128.88 -71.38 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.435 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.501 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 10.1 t30 156.22 119.22 0.0 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.18 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.74 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 19.0 Cg_endo -59.23 168.9 4.27 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 122.495 2.13 . . . . 0.0 112.661 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.452 HG21 HG21 ' A' ' 67' ' ' THR . 1.7 t -108.5 125.31 51.66 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 122.885 0.474 . . . . 0.0 110.54 0.108 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.808 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 42.8 m95 -95.92 168.56 10.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.584 0.707 . . . . 0.0 112.107 -179.195 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.755 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 8.4 m-70 -131.09 96.19 3.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.584 178.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.597 ' O ' ' HB1' ' B' ' 39' ' ' ALA . 78.9 m -104.44 122.49 45.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.201 0.524 . . . . 0.0 112.116 -178.026 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.783 HD13 ' HB3' ' A' ' 64' ' ' SER . 7.7 mt -127.77 109.16 19.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.382 179.015 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.006 HG12 ' HB2' ' B' ' 39' ' ' ALA . 1.6 p -111.04 118.65 57.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.321 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.929 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -138.79 -126.15 2.37 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.889 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.728 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -169.7 10.03 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.687 0.28 . . . . 0.0 111.147 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.728 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.1 OUTLIER 163.64 32.82 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.994 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.955 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.2 p90 -82.86 173.08 12.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.023 0.439 . . . . 0.0 111.004 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.94 76.88 0.32 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.894 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.993 ' HA ' HD12 ' A' ' 57' ' ' ILE . 53.1 p -72.52 122.2 20.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 0.0 111.415 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.802 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 23.3 t80 -133.92 77.39 1.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.309 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.969 HG21 ' CZ ' ' B' ' 86' ' ' PHE . 6.1 m -115.14 163.89 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.497 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.684 HG21 HG21 ' A' ' 53' ' ' THR . 19.7 m -95.62 73.33 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.464 179.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.62 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -46.57 179.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.4 -179.536 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.62 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -179.49 -177.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.467 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.527 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 56.13 -120.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.818 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.91 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.72 17.42 0.07 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.943 0.402 . . . . 0.0 110.672 179.82 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.945 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 17.7 m170 68.53 -90.36 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.827 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.744 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 1.0 OUTLIER 157.87 -164.68 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.566 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.96 HD12 ' CA ' ' B' ' 18' ' ' GLN . 0.2 OUTLIER -162.76 116.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.479 ' OH ' ' CZ ' ' B' ' 62' ' ' PHE . 1.1 t80 -107.02 134.65 49.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.29 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.887 ' CD2' HG22 ' B' ' 22' ' ' VAL . 2.9 p90 -152.35 165.34 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.086 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.589 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 26.7 t80 -126.33 108.95 11.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.049 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -69.86 170.47 11.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.763 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.477 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.97 -37.34 0.01 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.917 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.589 ' N ' ' O ' ' B' ' 78' ' ' LEU . 4.6 tt0 -158.5 41.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.745 0.307 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.929 HG13 ' O ' ' B' ' 59' ' ' GLY . 69.8 t -157.79 164.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.009 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.596 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -133.44 111.74 10.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.662 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.749 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -101.33 133.37 44.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.973 0.416 . . . . 0.0 111.482 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.622 HD23 HG13 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -119.74 103.92 9.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.156 179.628 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.744 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 4.3 mp -107.22 117.11 33.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.52 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.969 ' CZ ' HG21 ' B' ' 66' ' ' VAL . 25.1 p90 -153.34 138.39 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.925 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.808 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 5.3 mtpm? -100.65 159.63 15.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 111.207 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.43 19.33 14.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.818 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 89' ' ' GLY . . . . . 0.409 ' CA ' ' OG1' ' B' ' 70' ' ' THR . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.424 -1.209 . . . . 0.0 112.567 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.419 ' C ' HD13 ' A' ' 78' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.968 0.413 . . . . 0.0 110.73 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.047 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -123.9 -178.82 4.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.205 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.793 HG12 ' HE2' ' A' ' 9' ' ' LYS . 93.3 t -133.92 73.86 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.009 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.819 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -39.59 155.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.267 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.793 ' HE2' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -146.41 -10.03 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.567 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.442 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER 179.11 97.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.632 179.813 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.898 ' HB1' ' OE1' ' A' ' 18' ' ' GLN . . . -127.44 94.95 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.666 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 72' ' ' HIS . 88.1 m-20 -90.33 30.93 1.05 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.285 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.913 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.1 OUTLIER -116.59 166.83 11.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.644 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.89 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -45.65 122.94 3.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.797 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.636 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -38.01 -73.58 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.948 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.48 ' OE1' ' HA ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -44.52 -28.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.754 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.913 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -73.02 -43.63 61.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.812 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.971 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -59.9 -36.39 76.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.725 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.462 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 13.5 mt-30 -75.43 -39.77 58.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.137 0.494 . . . . 0.0 109.923 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.409 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -68.48 -29.01 67.53 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.41 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.833 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -68.53 -45.92 70.95 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.785 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 18' ' ' GLN . 17.4 t -56.55 -44.19 80.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.211 178.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 62.0 mt-10 -59.61 -41.58 90.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.269 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.739 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 53.6 t -65.08 -34.69 79.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.257 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.81 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -73.14 -32.98 65.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.622 ' HA ' HD12 ' A' ' 29' ' ' LEU . 23.5 m -70.22 -36.9 74.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.565 178.583 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.815 ' HB3' ' NE2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -62.31 -42.28 99.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.758 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.92 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -69.88 -28.94 66.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.859 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.81 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.5 mt -71.12 -58.7 3.3 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.813 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -36.61 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.859 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.788 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 15.1 mmtp -79.45 -35.77 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.887 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.605 ' HE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -153.56 152.11 30.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.886 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.93 ' HA ' HD11 ' A' ' 38' ' ' ILE . 9.3 m-20 -128.46 40.37 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.534 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.707 HG22 ' O ' ' A' ' 34' ' ' ILE . 33.2 mm -107.5 49.26 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.232 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.855 ' HG3' ' HA2' ' A' ' 59' ' ' GLY . 0.0 OUTLIER 34.72 -89.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.378 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.603 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -41.33 -46.9 3.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.987 0.422 . . . . 0.0 110.52 179.338 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.622 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 61.0 t0 -54.19 -61.13 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.81 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.93 HD11 ' HA ' ' A' ' 33' ' ' ASN . 3.5 mt -48.12 -50.72 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.078 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 1.031 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -52.13 -51.47 57.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.803 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -52.79 -51.31 61.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.698 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.851 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.6 OUTLIER -52.14 -47.0 65.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.55 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.931 HG21 HD11 ' A' ' 85' ' ' LEU . 37.1 mt -55.17 -71.88 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.189 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.784 ' HB3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -37.61 -55.2 1.14 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.997 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -44.26 -62.35 1.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.13 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.773 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 1.3 tp10 -55.54 -62.04 1.95 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.091 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.1 m-85 -41.67 -49.61 4.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.949 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.788 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 1.6 m-20 -56.58 -39.74 74.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.1 6.54 43.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.248 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.773 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -108.89 -20.72 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.098 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CE2' ' CD2' ' A' ' 46' ' ' PHE . 14.1 m-85 -140.62 -58.55 0.52 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.417 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.651 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 0.4 OUTLIER 159.21 118.37 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.292 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.788 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 29.3 Cg_endo -62.39 171.37 5.48 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 122.561 2.174 . . . . 0.0 112.407 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.795 HG21 HG21 ' B' ' 67' ' ' THR . 20.6 m -104.9 134.46 47.97 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 122.981 0.512 . . . . 0.0 110.648 0.064 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.807 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.6 m95 -105.7 145.45 31.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.49 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 1.053 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 0.2 OUTLIER -121.69 101.8 7.81 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.747 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.869 ' O ' HD13 ' A' ' 57' ' ' ILE . 8.6 p -107.66 146.79 31.56 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.087 HD12 ' HB2' ' B' ' 64' ' ' SER . 29.6 mm -134.47 107.37 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.548 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.031 HG12 ' HB2' ' A' ' 39' ' ' ALA . 7.2 p -107.86 116.35 51.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.545 -179.466 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.94 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -134.97 -134.11 3.35 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.192 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.715 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -167.36 11.12 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 120.827 0.346 . . . . 0.0 111.137 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.715 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 29.1 t-20 165.55 31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.909 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 3.0 p90 -91.32 -175.28 4.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.781 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.65 ' N ' ' HD1' ' A' ' 62' ' ' PHE . . . -138.41 101.32 0.32 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.87 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.98 ' CB ' HD12 ' B' ' 57' ' ' ILE . 87.6 p -87.45 144.88 26.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.196 0.522 . . . . 0.0 111.72 -179.297 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.759 ' H ' HD13 ' B' ' 57' ' ' ILE . 22.9 t80 -152.2 64.95 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.012 HG13 HD11 ' B' ' 57' ' ' ILE . 27.2 m -104.8 160.73 5.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.6 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.819 HG21 HG21 ' B' ' 53' ' ' THR . 2.3 m -87.0 -17.79 32.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.96 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.835 ' HB3' ' HB2' ' A' ' 86' ' ' PHE . 6.4 p-80 35.55 -157.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.714 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER 167.6 -155.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.91 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.533 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 41.65 -98.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.671 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.579 ' O ' ' HB2' ' A' ' 13' ' ' MET . 1.4 mmtp -91.27 32.83 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.712 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.726 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.2 OUTLIER 52.99 -88.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.95 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.726 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 28.0 p90 165.46 -174.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.007 0.432 . . . . 0.0 111.125 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 1.0 HG23 ' HE1' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -154.03 129.69 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.887 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.593 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -117.05 137.23 52.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.496 179.644 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 1.0 ' HE1' HG23 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -162.46 163.7 27.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.902 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.767 ' HE1' ' HA ' ' A' ' 80' ' ' GLN . 6.3 t80 -130.55 103.64 6.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.156 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.047 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.0 mm? -60.21 -178.82 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.833 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.02 -53.56 0.08 OUTLIER Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.54 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.767 ' HA ' ' HE1' ' A' ' 77' ' ' TYR . 0.3 OUTLIER -147.77 34.47 0.84 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.014 0.435 . . . . 0.0 110.415 179.468 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.94 HG13 ' O ' ' A' ' 59' ' ' GLY . 91.5 t -143.69 167.61 12.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.912 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.821 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -131.68 151.97 51.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.542 179.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.821 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.1 OUTLIER -138.84 134.06 42.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.995 0.426 . . . . 0.0 111.375 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.925 HD23 ' CG1' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -122.5 91.65 3.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.957 179.532 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.931 HD11 HG21 ' A' ' 42' ' ' ILE . 2.1 mp -93.71 125.28 38.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.63 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.835 ' HB2' ' HB3' ' A' ' 68' ' ' HIS . 27.9 p90 -158.95 122.54 3.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.807 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 40.3 mtpt -80.4 165.44 22.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.615 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' SER . . . . . 1.053 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 121.243 0.544 . . . . 0.0 110.634 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.854 HH11 ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.997 0.427 . . . . 0.0 110.723 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.644 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.1 OUTLIER -42.67 129.66 4.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.051 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.752 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.93 165.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.88 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.646 ' CG1' ' HE2' ' B' ' 9' ' ' LYS . 71.7 t -132.17 66.98 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.945 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.956 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.08 153.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.185 0.517 . . . . 0.0 110.731 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.748 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 0.9 OUTLIER -154.01 -4.95 0.17 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.565 ' O ' ' N ' ' B' ' 75' ' ' TYR . 1.6 m-20 -173.12 86.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.361 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.978 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -121.24 84.71 2.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.947 -179.28 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.531 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 0.3 OUTLIER -75.9 40.57 0.2 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.408 179.205 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.718 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 16.5 ttp -132.11 166.21 22.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.791 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.0 m -52.25 143.56 14.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.929 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 10.9 mt-10 -48.31 -65.82 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.993 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.482 ' H ' ' HG3' ' B' ' 16' ' ' GLU . 0.1 OUTLIER -51.74 -29.25 17.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.852 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.657 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -72.98 -32.04 64.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.827 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -76.1 -34.87 59.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.674 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.676 ' HG3' ' NH1' ' B' ' 4' ' ' ARG . 2.6 mp0 -75.8 -38.28 58.35 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.36 -30.85 66.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.652 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.772 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 77.5 p -67.77 -44.48 77.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.819 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' B' ' 76' ' ' PHE . 81.4 t -59.48 -50.19 80.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.477 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -55.0 -40.64 70.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.305 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 9.1 m -65.61 -35.24 80.24 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.813 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.673 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -71.8 -30.28 65.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.605 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 34.3 m -72.68 -39.35 67.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.593 178.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.671 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -55.99 -45.34 79.02 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.237 178.82 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.69 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -76.13 -22.17 55.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.042 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.881 HD21 HG11 ' B' ' 81' ' ' VAL . 4.6 mt -75.46 -34.17 60.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.651 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -90.0 -25.12 21.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.931 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.802 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.8 mmtm -85.2 -27.62 26.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.531 179.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.802 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -151.81 163.39 39.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.464 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.431 ' O ' ' CG ' ' B' ' 33' ' ' ASN . 28.4 t-20 -128.39 39.25 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.085 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.975 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 18.2 mm -120.54 104.41 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.9 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.727 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 0.8 OUTLIER -29.64 -66.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.045 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.756 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -51.75 -50.43 60.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.791 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.975 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.6 OUTLIER -53.84 -61.99 1.94 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.905 0.383 . . . . 0.0 110.44 179.695 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.861 ' HB ' HG11 ' B' ' 58' ' ' VAL . 5.0 mt -44.46 -48.65 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.017 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.878 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -58.98 -43.63 91.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.152 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.739 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -55.58 -64.51 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.921 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.69 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -51.31 -57.17 9.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.755 HD11 HG22 ' B' ' 38' ' ' ILE . 87.8 mt -43.52 -62.67 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.679 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 4.6 tttt -53.93 -30.67 47.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.576 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' B' ' 41' ' ' HIS . 3.9 mttt -68.38 -48.55 64.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.207 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.466 ' O ' ' CB ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -68.11 -42.16 80.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.665 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.772 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -63.26 -33.39 75.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.892 -179.922 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.785 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.7 OUTLIER -71.11 -49.22 46.6 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.96 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.403 ' HE3' ' HA ' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -79.14 -21.67 46.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.549 -179.485 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.804 ' HD3' ' O ' ' B' ' 49' ' ' LYS . 0.4 OUTLIER -90.53 -30.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.609 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.559 ' HD2' ' HA ' ' B' ' 46' ' ' PHE . 87.4 m-85 -115.52 -64.48 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.747 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 6.0 t30 158.94 114.37 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.183 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 85.1 Cg_exo -47.3 152.83 2.06 Favored 'Trans proline' 0 CA--C 1.533 0.426 0 C-N-CA 122.284 1.99 . . . . 0.0 112.659 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.819 HG21 HG21 ' A' ' 67' ' ' THR . 8.9 t -122.82 126.0 46.54 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 122.921 0.488 . . . . 0.0 111.036 0.116 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.999 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 44.5 m95 -90.62 117.16 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.747 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.782 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -96.07 109.16 21.62 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.497 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 1.095 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.5 OUTLIER -123.52 149.91 44.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.354 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 1.012 HD11 HG13 ' A' ' 66' ' ' VAL . 23.2 mm -130.76 109.79 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 0.878 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.8 p -110.27 125.67 67.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.93 0.395 . . . . 0.0 111.232 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.731 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -138.37 -128.28 2.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.965 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.746 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.6 OUTLIER -165.3 5.78 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.707 0.289 . . . . 0.0 111.613 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.746 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 2.0 t-20 164.32 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.81 0.338 . . . . 0.0 110.974 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.909 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -87.4 -171.15 3.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.043 0.449 . . . . 0.0 110.845 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.606 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -136.97 77.58 0.34 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.884 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 64' ' ' SER . . . . . 1.087 ' HB2' HD12 ' A' ' 57' ' ' ILE . 5.8 p -70.55 142.21 51.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.031 0.444 . . . . 0.0 111.23 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.863 ' H ' HD13 ' A' ' 57' ' ' ILE . 48.8 t80 -146.04 76.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.356 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.994 HG13 HD11 ' A' ' 57' ' ' ILE . 4.4 m -125.02 131.08 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.272 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.795 HG21 HG21 ' A' ' 53' ' ' THR . 2.6 t -78.31 130.61 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.024 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.494 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.1 OUTLIER -72.65 177.45 4.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.673 ' O ' HG23 ' B' ' 70' ' ' THR . 0.7 OUTLIER -163.97 38.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.247 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.673 HG23 ' O ' ' B' ' 69' ' ' GLU . 0.1 OUTLIER 178.99 -113.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.134 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.535 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -158.63 25.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.792 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 1.0 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 24.7 m-70 -124.58 44.82 2.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.795 ' HA ' ' HA ' ' B' ' 86' ' ' PHE . 8.1 t80 -124.33 90.51 3.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.545 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.978 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.8 OUTLIER -106.74 132.04 55.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.047 0.451 . . . . 0.0 111.508 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.699 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 18.3 t80 -119.78 134.04 55.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.818 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.956 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.1 OUTLIER -161.37 166.84 26.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.984 0.421 . . . . 0.0 111.16 -179.672 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.621 ' HB3' ' HB ' ' B' ' 7' ' ' VAL . 6.4 t80 -128.06 111.7 13.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.894 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 0.752 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.62 166.52 18.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.458 179.763 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.43 -60.85 0.1 Allowed Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.502 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.81 36.15 3.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.288 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.881 HG11 HD21 ' B' ' 29' ' ' LEU . 68.9 t -152.15 169.78 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.566 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.713 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -137.02 147.49 46.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.983 0.42 . . . . 0.0 110.998 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.741 HG13 ' CE2' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -133.26 131.7 58.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.074 -179.812 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.971 HD23 ' CG1' ' B' ' 57' ' ' ILE . 3.3 tp -123.83 83.73 2.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.701 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 1.095 HD12 ' HB2' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -87.45 131.85 34.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.007 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.795 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -160.98 125.6 3.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 1.0 ' HB2' ' HB2' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -105.54 143.75 33.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.737 179.879 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.782 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -91.47 19.47 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.251 0.548 . . . . 0.0 110.735 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 89' ' ' GLY . . . . . 0.618 ' O ' ' HE2' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.447 -1.196 . . . . 0.0 112.511 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.413 ' HD2' ' HA ' ' A' ' 5' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.985 0.422 . . . . 0.0 110.683 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.075 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.61 169.19 12.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.564 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 47.6 t -120.96 82.8 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.904 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -55.18 136.52 17.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.117 0.484 . . . . 0.0 110.639 -179.885 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.564 ' HE2' ' CG1' ' A' ' 7' ' ' VAL . 0.5 OUTLIER -125.19 -12.85 6.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.041 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.6 ' O ' ' N ' ' A' ' 75' ' ' TYR . 29.9 t30 -176.51 122.85 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.356 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.783 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -149.89 91.03 1.74 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.816 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -75.32 28.52 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.139 0.495 . . . . 0.0 109.841 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.889 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 2.0 ttm -114.14 163.28 15.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.77 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.777 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.2 OUTLIER -56.9 137.78 54.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.644 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.1 mp0 -41.76 -78.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 16' ' ' GLU . 2.8 mm-40 -40.02 -27.29 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.779 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.842 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.4 -42.44 53.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.849 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.883 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -64.85 -32.86 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.894 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -76.28 -42.04 46.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.157 0.503 . . . . 0.0 109.717 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.49 -30.73 67.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.669 179.058 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.823 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 21.9 t -66.84 -45.1 79.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 18' ' ' GLN . 46.8 t -59.98 -46.74 93.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.31 -40.74 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.071 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.786 ' HA ' ' HG3' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -66.23 -38.45 87.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.079 179.361 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.724 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -68.61 -26.93 65.61 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.547 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.3 m -73.84 -40.23 63.46 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.795 178.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.786 ' HG3' ' HA ' ' A' ' 24' ' ' CYS . 7.0 mt-30 -56.87 -44.34 82.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.75 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.853 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -79.45 -21.83 44.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.544 179.376 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 1.093 HD21 HG11 ' A' ' 81' ' ' VAL . 6.5 mt -73.25 -44.09 60.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.084 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -81.48 -29.64 33.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.075 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.493 ' CB ' ' CE1' ' A' ' 32' ' ' TYR . 2.4 mttm -77.77 -36.13 50.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.757 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.627 ' CD1' ' N ' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -150.33 151.8 33.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.815 179.693 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 1.043 ' HA ' HD11 ' A' ' 38' ' ' ILE . 1.6 m-80 -125.88 35.44 4.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.074 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.978 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 36.2 mm -98.44 32.09 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.099 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.756 ' N ' HD12 ' A' ' 38' ' ' ILE . 4.1 mp0 41.24 -86.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.376 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.615 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.75 -50.98 5.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.307 179.26 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.978 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.9 OUTLIER -53.99 -54.24 41.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.323 179.368 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 1.043 HD11 ' HA ' ' A' ' 33' ' ' ASN . 4.7 mt -54.33 -59.08 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.829 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 1.015 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -48.74 -40.38 28.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.779 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -54.66 -67.59 0.25 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.81 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.624 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -49.05 -45.72 43.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.76 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.796 HD11 HG22 ' A' ' 38' ' ' ILE . 58.7 mt -49.96 -48.8 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.969 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.651 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 8.4 tmtt? -66.81 -59.64 3.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.472 ' O ' ' OD1' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -40.04 -57.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.958 0.409 . . . . 0.0 110.971 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.697 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 1.6 tp10 -60.93 -38.25 85.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.263 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.823 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -69.19 -27.23 65.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.085 -179.651 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.816 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -90.3 -13.95 34.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 0.0 110.414 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.609 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -111.39 -8.8 14.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.611 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.725 ' HD2' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -106.56 -23.1 12.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.216 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.725 ' CE1' ' HD2' ' A' ' 49' ' ' LYS . 3.9 m-85 -123.94 -62.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.518 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.483 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 1.3 t30 156.19 121.98 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.973 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.816 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 31.4 Cg_endo -63.03 172.26 5.17 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.646 2.231 . . . . 0.0 112.686 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.666 HG22 ' CE1' ' A' ' 55' ' ' HIS . 36.0 m -102.08 133.72 46.47 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 122.819 0.448 . . . . 0.0 110.492 -0.035 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.767 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 56.0 m95 -104.23 140.23 38.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.286 0.565 . . . . 0.0 112.147 -179.081 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 1.062 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 0.1 OUTLIER -130.43 99.83 5.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.212 -0.903 . . . . 0.0 108.811 178.767 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 1.063 ' HB2' HD12 ' A' ' 85' ' ' LEU . 0.5 OUTLIER -116.89 167.81 10.79 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -177.648 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.958 HD13 ' O ' ' A' ' 56' ' ' CYS . 17.5 mm -135.14 156.49 39.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.789 178.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.015 HG12 ' HB2' ' A' ' 39' ' ' ALA . 10.0 p -158.9 109.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.935 0.397 . . . . 0.0 111.629 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.855 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -139.44 -130.76 2.75 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.019 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.628 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -164.04 -28.9 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 120.737 0.303 . . . . 0.0 111.416 -179.678 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.45 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 53.0 t30 -152.88 45.98 0.69 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.964 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 1.009 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -103.0 -163.26 0.98 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.973 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.817 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.43 90.84 0.15 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.073 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.96 ' HA ' HG12 ' B' ' 57' ' ' ILE . 3.3 p -78.28 147.05 34.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.407 . . . . 0.0 111.22 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.828 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 13.2 t80 -154.6 62.61 0.67 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.645 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.74 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 4.5 m -124.59 140.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.324 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.901 ' CG2' HG21 ' B' ' 53' ' ' THR . 15.2 t -86.16 149.91 24.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.706 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.429 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -78.3 -157.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.937 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.1 OUTLIER -140.86 -51.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.764 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 t -141.01 -60.37 0.49 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.868 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.764 ' HG2' ' C ' ' A' ' 70' ' ' THR . 0.0 OUTLIER -157.03 -136.88 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.776 -179.933 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.853 ' HA ' ' HG3' ' A' ' 13' ' ' MET . 2.9 m-70 31.75 35.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.889 ' N ' ' HB2' ' A' ' 13' ' ' MET . 6.5 t80 -116.73 100.69 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.748 0.309 . . . . 0.0 110.735 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.815 HD11 HD11 ' A' ' 8' ' ' ILE . 2.4 tt -117.19 153.17 18.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.969 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 10' ' ' ASN . 10.0 t80 -149.83 93.23 2.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.66 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.904 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -113.78 -176.17 2.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.33 -179.51 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.623 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 31.1 t80 -143.0 91.03 2.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.811 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.075 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -49.4 174.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.927 -179.945 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.461 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.19 -59.95 0.26 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.577 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -133.57 34.05 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.753 0.311 . . . . 0.0 110.729 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 1.093 HG11 HD21 ' A' ' 29' ' ' LEU . 96.2 t -148.97 164.22 4.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.272 -179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.992 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -129.95 153.18 48.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.59 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.992 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.1 OUTLIER -144.5 118.49 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.373 . . . . 0.0 111.039 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.868 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 6.5 tp -107.48 86.55 2.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 1.063 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -87.75 138.69 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.466 -179.868 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.719 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -175.5 125.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.321 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.767 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 53.1 mtpt -82.12 -171.7 3.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.797 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' SER . . . . . 1.062 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 2.2 m . . . . . 0 C--N 1.327 -0.409 0 CA-C-O 121.305 0.574 . . . . 0.0 110.353 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.493 ' HB2' ' H ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.821 0.343 . . . . 0.0 110.973 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.666 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.2 OUTLIER 59.78 108.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.051 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.21 -168.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.633 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.78 HG12 ' HE2' ' B' ' 9' ' ' LYS . 10.5 t -157.03 73.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.901 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.853 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -38.16 150.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.78 ' HE2' HG12 ' B' ' 7' ' ' VAL . 63.2 mmtt -146.9 -3.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.485 ' O ' ' N ' ' B' ' 75' ' ' TYR . 2.5 t30 179.02 83.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.147 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.827 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -109.63 72.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.794 -179.151 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.766 ' HB2' ' HD2' ' B' ' 73' ' ' PHE . 0.6 OUTLIER -73.52 33.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.752 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.954 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -129.56 172.05 11.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.716 -178.782 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.872 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.98 133.21 32.83 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.94 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.987 ' HA ' HE21 ' B' ' 18' ' ' GLN . 3.2 mp0 -51.64 -69.43 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.408 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -52.21 -29.83 24.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.517 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.825 ' HG2' ' CG ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -75.17 -32.79 61.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.968 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.987 HE21 ' HA ' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -76.06 -28.59 57.69 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.854 0.359 . . . . 0.0 110.352 179.271 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.487 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 5.2 mm100 -72.87 -40.29 65.76 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.545 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 8.7 m-20 -68.33 -30.59 69.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.17 178.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -62.97 -48.7 77.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.976 178.97 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.954 HG22 ' CD2' ' B' ' 76' ' ' PHE . 95.5 t -55.25 -51.86 51.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.006 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 7.9 mt-10 -54.77 -36.34 64.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.862 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -36.18 70.41 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.657 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -70.65 -23.14 62.46 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.524 ' HA ' HD12 ' B' ' 29' ' ' LEU . 6.5 m -78.59 -42.2 29.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.599 178.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.78 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -54.04 -46.54 71.91 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.59 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.891 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -69.73 -36.77 76.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.005 178.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.655 HD11 ' HG ' ' B' ' 78' ' ' LEU . 5.8 mt -58.27 -53.0 63.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.026 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.608 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.78 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 11.0 mmmt -75.99 -25.68 56.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.3 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.513 ' CG ' ' C ' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -171.92 133.51 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.868 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -92.76 26.58 2.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.043 0.449 . . . . 0.0 110.601 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.662 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 42.8 mm -96.39 103.57 14.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.688 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 1.032 ' HG3' ' HA2' ' B' ' 59' ' ' GLY . 0.2 OUTLIER -30.05 -70.46 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.556 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -48.15 -53.77 15.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.806 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.662 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 18.3 t0 -48.77 -62.17 1.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.63 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.969 ' HB ' HG11 ' B' ' 58' ' ' VAL . 16.6 mt -44.12 -50.78 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.047 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.81 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -54.58 -47.54 73.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.984 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.828 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -60.01 -50.83 72.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.626 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.803 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.0 OUTLIER -52.9 -50.63 63.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.718 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.689 HD11 HG22 ' B' ' 38' ' ' ILE . 19.2 mt -59.97 -70.5 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.641 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.733 ' HD2' ' CE2' ' A' ' 65' ' ' TYR . 0.6 OUTLIER -38.54 -33.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.93 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.431 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 18.2 tttp -68.92 -60.45 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.034 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.764 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 3.0 mm-40 -62.29 -24.8 67.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.881 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -76.73 -38.81 53.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.605 179.759 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.608 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.6 OUTLIER -66.11 -35.59 80.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.714 179.791 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.505 ' HE2' ' HB3' ' B' ' 48' ' ' LYS . 3.0 mmmm -88.6 -32.51 18.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.764 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -76.35 -25.44 54.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.894 179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.702 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 26.0 m-85 -130.45 -68.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.702 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 1.4 t30 155.02 119.2 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.188 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.619 ' CB ' ' HA ' ' B' ' 53' ' ' THR . 20.7 Cg_endo -60.4 175.73 1.03 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.326 2.018 . . . . 0.0 112.346 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.901 HG21 ' CG2' ' A' ' 67' ' ' THR . 2.0 m -100.51 131.44 46.43 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.951 0.5 . . . . 0.0 110.547 0.04 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.818 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 64.6 m95 -103.14 100.86 10.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.007 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.74 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 20.5 m170 -73.45 94.37 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.077 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.982 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.5 OUTLIER -111.22 154.28 24.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.276 0.56 . . . . 0.0 112.148 -177.985 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.96 HG12 ' HA ' ' A' ' 64' ' ' SER . 29.9 mt -151.15 110.84 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.71 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 0.969 HG11 ' HB ' ' B' ' 38' ' ' ILE . 1.4 p -107.03 131.61 56.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.187 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 1.032 ' HA2' ' HG3' ' B' ' 35' ' ' GLU . . . -149.46 -134.06 2.28 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.842 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.429 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 1.5 ptm180 -161.51 1.66 0.06 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 120.704 0.288 . . . . 0.0 111.105 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.488 ' O ' ' CD ' ' A' ' 35' ' ' GLU . 1.2 t-20 174.55 34.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.162 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 1.009 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 54.8 p90 -90.48 174.48 7.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 0.0 110.76 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.626 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -123.02 74.17 0.39 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.035 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.889 ' HA ' HG23 ' A' ' 57' ' ' ILE . 28.4 p -74.35 102.76 4.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.879 0.371 . . . . 0.0 111.087 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.818 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 12.7 t80 -109.47 67.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.939 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.983 HG21 ' CE1' ' B' ' 86' ' ' PHE . 18.6 m -101.14 165.65 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.026 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.86 ' H ' ' CD2' ' A' ' 55' ' ' HIS . 2.3 m -115.15 95.52 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.973 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.631 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.0 OUTLIER -54.17 175.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.885 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.677 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.4 OUTLIER -168.76 80.02 0.14 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.977 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.65 HG23 ' H ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 163.62 -97.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.901 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.726 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -175.72 16.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.552 179.95 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.954 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 93.5 m-70 -126.93 69.47 1.27 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.864 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.0 t80 -128.83 75.33 1.63 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.507 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.827 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 1.2 tt -91.23 129.38 42.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.376 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.682 ' CD1' ' HB2' ' B' ' 84' ' ' LEU . 17.1 t80 -128.29 87.45 2.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.489 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.954 ' CD2' HG22 ' B' ' 22' ' ' VAL . 4.8 p90 -109.7 164.27 12.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.24 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.711 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 53.8 t80 -123.38 114.79 20.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.71 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.051 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.57 166.14 19.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.823 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.483 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -30.81 -36.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.66 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -151.33 30.73 0.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.914 0.388 . . . . 0.0 110.777 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.755 ' HB ' ' HB2' ' B' ' 78' ' ' LEU . 42.5 t -146.0 168.84 6.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.915 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.711 ' HB2' ' HD2' ' B' ' 77' ' ' TYR . . . -137.34 109.22 7.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.322 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.73 HD13 HG23 ' B' ' 58' ' ' VAL . 0.9 OUTLIER -101.25 133.78 43.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.239 0.542 . . . . 0.0 112.068 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.733 ' O ' HD12 ' B' ' 85' ' ' LEU . 0.1 OUTLIER -119.28 132.27 55.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.873 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.982 HD12 ' HB2' ' B' ' 56' ' ' CYS . 3.2 mp -137.35 101.5 4.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.983 ' CE1' HG21 ' B' ' 66' ' ' VAL . 12.5 p90 -139.61 123.87 17.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.97 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.805 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -91.8 159.18 15.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.677 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 1.3 m -117.64 19.95 13.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.31 0.576 . . . . 0.0 110.246 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.55 -179.891 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.565 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.846 0.355 . . . . 0.0 111.166 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.025 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -139.09 170.43 15.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.456 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 26.3 t -131.15 85.81 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.043 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.853 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -49.32 156.54 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.193 0.521 . . . . 0.0 110.826 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.74 ' HD3' ' O ' ' A' ' 8' ' ' ILE . 1.2 mmtp -144.78 -14.93 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.935 179.581 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -167.77 77.97 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.396 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.813 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -101.78 76.33 1.63 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.673 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.497 ' OD2' ' CD2' ' A' ' 68' ' ' HIS . 59.3 t0 -77.93 30.25 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.132 0.491 . . . . 0.0 109.973 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.922 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.4 OUTLIER -121.91 163.34 19.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 -179.481 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.841 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -50.13 128.43 19.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.976 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.771 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.3 mm-40 -37.83 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.022 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.797 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.9 OUTLIER -44.33 -31.1 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.922 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -70.94 -37.01 72.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.249 179.535 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.855 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -68.54 -30.29 69.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.475 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 6.3 pt20 -76.77 -38.3 54.34 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.4 -25.75 62.47 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.655 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.844 ' OG ' HG21 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -72.96 -50.66 22.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.106 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.855 HG23 ' O ' ' A' ' 18' ' ' GLN . 17.2 t -60.15 -38.27 76.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.528 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.716 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 47.5 mt-10 -67.15 -38.66 85.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.897 179.452 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.5 m -70.18 -34.77 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.606 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.845 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -72.52 -36.38 68.31 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.706 ' HA ' HD12 ' A' ' 29' ' ' LEU . 52.0 m -69.05 -36.5 77.75 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.565 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -61.5 -39.35 90.65 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.479 178.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.973 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -71.92 -28.75 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.604 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.845 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.2 mt -72.7 -41.39 65.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.81 -32.75 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.152 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HB3' ' CE2' ' A' ' 32' ' ' TYR . 1.2 mtpp -86.71 -26.59 24.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.043 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.603 ' HE1' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.18 178.18 10.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.746 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 1.062 ' HA ' HD11 ' A' ' 38' ' ' ILE . 9.6 p30 -158.39 40.19 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.02 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.006 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 42.0 mm -103.61 39.28 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.652 ' HB3' ' C ' ' B' ' 62' ' ' PHE . 4.5 mp0 43.33 -86.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.252 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.606 ' N ' ' O ' ' A' ' 34' ' ' ILE . 2.9 mtpt -48.82 -33.36 10.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.874 0.369 . . . . 0.0 110.228 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 1.006 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -65.88 -45.66 81.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.264 179.472 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 1.062 HD11 ' HA ' ' A' ' 33' ' ' ASN . 2.8 mp -65.1 -38.4 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.473 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.941 ' HB1' ' HB2' ' B' ' 65' ' ' TYR . . . -61.53 -43.13 99.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.424 179.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.739 ' HB2' ' CE1' ' B' ' 65' ' ' TYR . . . -62.38 -55.76 24.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.284 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.935 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.7 OUTLIER -47.81 -47.08 31.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.461 179.328 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.822 HG12 ' HA ' ' A' ' 25' ' ' ALA . 14.1 mt -67.18 -69.25 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.138 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.636 ' HG3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -43.42 -35.27 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.056 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.511 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -66.21 -62.19 1.62 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.821 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.641 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 13.5 mt-10 -52.98 -51.24 62.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.815 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -53.12 -52.14 59.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.79 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -57.43 -27.03 62.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.027 -179.876 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -113.94 9.61 17.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.147 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.641 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -121.73 -5.12 9.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.111 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.613 ' CD1' ' HA ' ' A' ' 46' ' ' PHE . 11.5 m-85 -148.56 -61.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.307 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.603 ' ND2' ' O ' ' A' ' 50' ' ' TYR . 1.3 p30 161.45 117.08 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.445 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.79 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 33.2 Cg_endo -64.23 167.21 15.0 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.449 2.099 . . . . 0.0 112.568 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.884 HG21 HG21 ' B' ' 67' ' ' THR . 4.9 t -109.54 122.28 47.07 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.757 0.423 . . . . 0.0 110.773 -0.103 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.703 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 28.4 m95 -89.7 135.86 33.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.841 -179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.831 ' CE1' HG22 ' B' ' 67' ' ' THR . 0.0 OUTLIER -102.21 104.84 15.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.161 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.594 ' HB3' HD12 ' A' ' 85' ' ' LEU . 1.6 m -113.11 125.14 54.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.121 0.486 . . . . 0.0 112.171 -178.148 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.736 HG12 ' HA ' ' B' ' 64' ' ' SER . 13.4 mt -126.42 99.73 5.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.781 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.841 HG11 ' HB ' ' A' ' 38' ' ' ILE . 3.3 p -99.63 123.54 52.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.996 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.771 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -146.0 -150.69 5.25 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.171 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.751 HH11 ' HG3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -158.28 13.5 0.19 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.676 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 35.1 t30 174.08 35.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.449 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.933 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -100.06 157.78 16.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.152 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.91 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -114.73 83.75 0.34 Allowed Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.858 ' CB ' HD12 ' B' ' 57' ' ' ILE . 84.5 p -79.78 137.94 37.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.1 0.476 . . . . 0.0 111.75 -178.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.911 ' HB2' ' HB1' ' B' ' 39' ' ' ALA . 1.5 t80 -141.35 58.09 1.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.263 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.791 HG21 ' CE1' ' A' ' 86' ' ' PHE . 27.5 m -104.94 129.63 57.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.039 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.504 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 5.2 m -81.7 123.76 29.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.497 ' CD2' ' OD2' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -71.79 172.92 8.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.613 179.743 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.537 ' O ' ' HB ' ' A' ' 70' ' ' THR . 7.3 pt-20 -169.74 75.09 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.066 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.776 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 1.5 t 165.58 -104.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 70' ' ' THR . 17.3 mtmt -171.91 18.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.814 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.744 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 66.5 m-70 -130.56 67.47 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.707 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.689 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 1.8 t80 -133.16 93.42 3.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.597 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.844 HG21 ' OG ' ' A' ' 21' ' ' SER . 3.2 tt -108.96 122.69 64.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.323 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.759 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 34.9 t80 -116.11 88.51 2.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.453 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.853 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -113.3 168.85 9.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.934 0.397 . . . . 0.0 111.411 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.692 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 10.0 t80 -130.09 100.51 5.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.725 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.025 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.1 mm? -53.95 172.15 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -36.09 -36.57 0.14 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.689 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.522 ' O ' HG23 ' A' ' 81' ' ' VAL . 6.7 tp60 -151.5 41.23 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.915 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.656 HG13 ' O ' ' A' ' 59' ' ' GLY . 42.1 t -158.6 166.54 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.014 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.692 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -134.33 110.12 9.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.602 HD13 HG23 ' A' ' 58' ' ' VAL . 0.3 OUTLIER -99.71 118.1 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.038 0.447 . . . . 0.0 111.597 -179.28 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.759 ' HB2' ' CE1' ' A' ' 75' ' ' TYR . 1.6 tp -102.74 90.68 3.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.111 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.689 ' O ' ' HA ' ' A' ' 73' ' ' PHE . 0.6 OUTLIER -99.23 124.62 44.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.478 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.791 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.3 p90 -168.57 132.72 1.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.209 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.683 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -92.94 168.2 11.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.847 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.633 ' CB ' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 121.168 0.509 . . . . 0.0 110.826 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.441 ' O ' HG11 ' B' ' 22' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.812 0.339 . . . . 0.0 110.505 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.675 ' HE3' ' H ' ' B' ' 6' ' ' ALA . 0.0 OUTLIER 57.42 -168.04 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.34 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.122 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 57.94 -178.34 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.514 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.757 ' O ' ' HD2' ' B' ' 9' ' ' LYS . 80.3 t -147.78 75.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.776 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.887 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -44.28 153.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.008 0.432 . . . . 0.0 110.211 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.767 ' HD2' ' HA ' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -135.29 -22.92 1.51 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.242 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.598 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 2.2 t-20 -145.74 -104.66 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.998 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.756 ' CB ' ' HA ' ' B' ' 74' ' ' ILE . . . 76.19 129.64 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.08 0.467 . . . . 0.0 112.091 178.828 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.711 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -124.49 35.22 4.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.169 179.094 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.695 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 23.0 ttp -121.28 158.2 28.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.962 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.707 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -38.87 158.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 179.747 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.69 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 13.1 mt-10 -67.17 -57.39 6.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.011 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.1 OUTLIER -55.75 -24.82 37.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.658 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.695 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -78.35 -43.53 27.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.856 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -60.75 -37.79 82.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.923 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.406 ' HG2' ' NE ' ' B' ' 4' ' ' ARG . 0.4 OUTLIER -74.74 -42.21 58.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.181 0.515 . . . . 0.0 109.907 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.64 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -65.19 -31.87 73.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.904 179.1 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.911 ' HB2' HD22 ' B' ' 85' ' ' LEU . 1.0 OUTLIER -66.01 -49.4 67.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.978 179.172 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.992 HG22 ' CD2' ' B' ' 76' ' ' PHE . 92.5 t -53.28 -46.52 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.672 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 5.0 mm-40 -61.94 -35.81 79.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.416 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.513 ' HB3' HG23 ' B' ' 42' ' ' ILE . 0.8 OUTLIER -70.48 -32.43 69.95 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.005 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.88 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.99 -40.59 68.45 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.659 ' HA ' HD12 ' B' ' 29' ' ' LEU . 85.2 m -64.94 -42.51 94.58 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.876 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.534 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 81.1 mt-30 -55.1 -46.84 75.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.853 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.885 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -63.45 -32.62 74.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.38 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.88 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.0 OUTLIER -68.51 -51.39 43.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.186 -179.778 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -33.25 71.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.969 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.421 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 13.1 mttt -82.88 -35.09 26.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.77 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.487 ' HE2' ' HB2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -146.64 150.87 36.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.737 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.661 ' C ' HD13 ' B' ' 34' ' ' ILE . 0.1 OUTLIER -114.97 32.05 6.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.007 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.967 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.1 mm -114.93 110.97 33.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.82 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.91 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 3.4 mp0 -29.99 -70.79 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.24 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.912 ' HE3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -46.23 -48.25 17.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.738 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.967 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -56.9 -62.16 1.94 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.631 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.885 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 4.2 mt -45.82 -45.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 1.069 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -59.35 -55.33 36.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.713 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.794 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -51.02 -45.07 61.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.667 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.845 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.5 t60 -59.1 -50.95 72.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.787 HG12 ' HA ' ' B' ' 25' ' ' ALA . 26.0 mt -60.71 -70.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.288 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.653 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 1.5 ttpt -37.19 -57.14 0.89 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.54 -44.67 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.087 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.2 OUTLIER -63.8 -33.72 76.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.759 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.761 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -74.67 -36.38 62.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.702 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.79 ' OD2' ' HB3' ' B' ' 52' ' ' PRO . 0.2 OUTLIER -68.82 -35.71 77.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.953 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.461 ' HE3' ' HB3' ' B' ' 48' ' ' LYS . 17.6 mmmt -90.75 -38.76 12.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.774 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.569 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.0 OUTLIER -77.79 -22.42 50.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.887 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.77 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 77.7 m-85 -120.61 -71.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.265 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.77 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.5 t-20 158.54 118.68 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.79 ' HB3' ' OD2' ' B' ' 47' ' ' ASP . 10.6 Cg_endo -53.3 167.21 0.86 Allowed 'Trans proline' 0 CA--C 1.534 0.484 0 C-N-CA 122.438 2.092 . . . . 0.0 112.791 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.64 HG22 ' NE2' ' B' ' 55' ' ' HIS . 16.3 m -104.68 131.37 52.19 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.774 0.43 . . . . 0.0 110.55 0.073 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.764 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 60.4 m95 -105.81 139.36 40.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.358 0.599 . . . . 0.0 111.884 -179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.827 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.1 98.76 4.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.642 178.662 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.777 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 0.4 OUTLIER -119.87 162.03 19.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.453 0.644 . . . . 0.0 112.485 -177.795 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.881 ' HB ' ' HB3' ' B' ' 84' ' ' LEU . 20.0 mm -127.94 162.31 34.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.43 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.069 HG12 ' HB2' ' B' ' 39' ' ' ALA . 4.9 p -160.24 102.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.833 0.349 . . . . 0.0 111.331 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.833 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -136.73 -123.72 2.27 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.102 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -174.61 -46.15 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.787 0.327 . . . . 0.0 111.2 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m-20 -132.25 52.99 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.235 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.933 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -113.84 -154.08 0.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.909 0.385 . . . . 0.0 110.642 179.792 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.713 ' O ' ' HA ' ' A' ' 57' ' ' ILE . . . -154.53 103.84 0.24 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.676 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.736 ' HA ' HG12 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -96.2 137.9 34.6 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.121 0.486 . . . . 0.0 111.486 -179.205 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.941 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -143.83 51.71 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.157 179.6 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.698 HG12 ' HB3' ' A' ' 55' ' ' HIS . 4.5 m -99.6 139.9 20.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.44 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.884 HG21 HG21 ' A' ' 53' ' ' THR . 2.3 t -76.69 138.4 39.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.483 ' CD2' ' CB ' ' B' ' 12' ' ' ASP . 13.9 p-80 -110.81 159.04 18.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.58 176.71 12.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.657 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.651 ' C ' ' HG2' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 66.42 -92.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.976 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.651 ' HG2' ' C ' ' B' ' 70' ' ' THR . 0.9 OUTLIER 164.97 43.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.934 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.564 ' CG ' ' HD3' ' B' ' 87' ' ' LYS . 89.3 m-70 -134.32 46.86 2.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.717 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.711 ' HD1' ' H ' ' B' ' 12' ' ' ASP . 1.0 OUTLIER -126.94 139.93 52.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.525 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.856 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.5 OUTLIER -149.64 129.32 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.956 0.408 . . . . 0.0 111.595 179.819 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.732 ' HD1' HD12 ' B' ' 84' ' ' LEU . 8.5 t80 -114.2 133.54 55.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.986 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.992 ' CD2' HG22 ' B' ' 22' ' ' VAL . 0.2 OUTLIER -165.23 170.02 15.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.344 -179.506 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.693 ' OH ' ' HA ' ' B' ' 80' ' ' GLN . 5.8 t80 -132.67 116.7 16.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.042 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.122 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 3.7 mm? -69.91 167.04 18.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.553 ' O ' ' HG2' ' B' ' 80' ' ' GLN . . . -28.3 -37.23 0.01 OUTLIER Glycine 0 CA--C 1.519 0.296 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.949 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.693 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 5.3 mt-30 -154.42 38.8 0.44 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.727 0.299 . . . . 0.0 111.08 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.833 HG13 ' O ' ' B' ' 59' ' ' GLY . 53.2 t -158.32 167.9 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.111 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.98 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -124.36 160.45 28.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.662 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.98 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.0 OUTLIER -147.5 131.6 9.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 0.0 111.409 -179.583 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.881 ' HB3' ' HB ' ' B' ' 57' ' ' ILE . 4.0 tp -122.73 90.92 3.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.911 HD22 ' HB2' ' B' ' 21' ' ' SER . 0.9 OUTLIER -92.89 140.92 28.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.051 0.453 . . . . 0.0 111.682 -179.216 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.73 ' HZ ' ' HZ ' ' A' ' 86' ' ' PHE . 1.4 p90 -177.09 131.86 0.18 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.749 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.764 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.8 OUTLIER -96.73 158.65 15.33 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.56 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.827 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -103.17 19.22 19.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.235 0.54 . . . . 0.0 110.511 179.799 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.424 -179.986 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.729 ' O ' HD13 ' A' ' 78' ' ' LEU . 15.3 tppt? . . . . . 0 C--O 1.23 0.045 0 CA-C-O 120.645 0.26 . . . . 0.0 110.936 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.028 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 156.21 156.95 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.719 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.49 ' C ' ' H ' ' A' ' 77' ' ' TYR . 58.0 t -123.38 78.85 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.006 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.866 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -48.85 164.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.171 0.51 . . . . 0.0 110.636 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.743 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -163.16 -13.47 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.975 179.733 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.572 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -164.52 89.12 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.32 179.863 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.852 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -126.03 93.43 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.715 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 73' ' ' PHE . 9.1 t70 -85.15 28.98 0.68 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.906 179.007 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.758 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 34.6 ttp -120.28 157.67 28.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.983 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.79 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 2.3 m -41.32 147.36 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.556 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.773 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.9 OUTLIER -54.89 -56.29 21.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.248 -179.69 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.9 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.2 OUTLIER -62.29 -27.59 69.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.944 0.402 . . . . 0.0 110.251 179.78 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.76 ' HA ' ' OD2' ' A' ' 20' ' ' ASP . 39.7 mmm -71.29 -30.82 66.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.498 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.956 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -79.25 -29.03 42.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.212 179.327 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.9 ' HG2' ' HA ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -77.53 -43.95 30.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.652 179.165 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.76 ' OD2' ' HA ' ' A' ' 17' ' ' MET . 4.9 p30 -70.86 -31.05 67.62 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.492 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.771 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.3 t -65.14 -46.26 81.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.041 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.821 HG22 ' CD2' ' A' ' 76' ' ' PHE . 53.0 t -59.51 -46.87 92.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.088 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.705 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 28.7 mt-10 -56.46 -34.25 66.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.863 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.624 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 49.8 t -71.46 -36.53 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.076 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.765 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -71.78 -30.78 65.91 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.65 ' HA ' HD12 ' A' ' 29' ' ' LEU . 27.8 m -71.92 -37.99 69.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.252 -1.34 . . . . 0.0 109.429 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.817 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.7 OUTLIER -59.69 -44.41 93.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.608 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.979 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -71.91 -25.61 61.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.838 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.711 HD12 ' O ' ' A' ' 25' ' ' ALA . 3.0 mt -72.82 -45.73 56.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.148 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -77.83 -21.88 50.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.817 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 23.9 mmtt -90.04 -26.47 20.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.084 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -166.98 115.22 0.83 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.949 -179.844 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.47 ' OD1' ' O ' ' A' ' 29' ' ' LEU . 28.9 m-20 -81.54 32.79 0.35 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.087 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.816 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 39.7 mm -102.62 101.68 12.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.101 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.515 ' C ' ' O ' ' A' ' 34' ' ' ILE . 1.8 mp0 -24.15 -86.96 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.408 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -40.03 -37.11 0.55 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.754 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.816 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -63.15 -62.19 1.87 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.645 179.811 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.979 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 20.8 mt -47.34 -44.22 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.661 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 1.038 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -58.22 -46.98 84.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.483 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.802 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -57.97 -61.09 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.325 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.843 ' CG ' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -40.98 -58.6 1.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.607 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.991 HG21 HD11 ' A' ' 85' ' ' LEU . 6.1 mt -52.22 -70.94 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.747 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -38.17 -54.84 1.35 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.031 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.31 -62.74 1.28 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.042 0.448 . . . . 0.0 110.963 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.76 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -52.11 -50.7 61.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.152 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.771 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -57.81 -35.67 71.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.777 ' HA ' ' HD1' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -74.13 -21.16 59.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -122.39 13.38 10.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.331 -179.728 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.76 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -129.37 6.35 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.39 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CD2' ' CD1' ' A' ' 46' ' ' PHE . 97.2 m-85 -148.61 -65.65 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 0.0 111.225 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.453 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 2.6 t-20 163.34 102.83 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.733 ' HA ' ' OD1' ' A' ' 47' ' ' ASP . 45.8 Cg_exo -36.87 154.49 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.665 2.243 . . . . 0.0 112.711 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.814 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 25.9 m -114.44 140.86 48.36 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.047 0.539 . . . . 0.0 110.369 -0.082 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.777 ' HD1' ' HA ' ' A' ' 47' ' ' ASP . 76.9 m95 -105.62 145.09 31.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.527 0.68 . . . . 0.0 112.422 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.919 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 4.5 m-70 -136.18 101.66 4.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.819 179.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.838 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.76 165.74 14.15 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.796 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.036 HG13 HD23 ' A' ' 84' ' ' LEU . 17.8 mm -133.86 169.66 21.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.22 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.038 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.0 p -166.13 117.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.78 0.324 . . . . 0.0 111.475 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.624 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -151.08 -154.41 6.52 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.06 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.754 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -157.54 32.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.759 0.314 . . . . 0.0 111.388 -179.757 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.754 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 14.0 t-20 163.94 29.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.74 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.833 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.0 OUTLIER -106.6 172.89 6.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.312 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.831 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.2 94.51 0.43 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.921 ' HB2' HD22 ' A' ' 84' ' ' LEU . 69.6 p -82.01 123.61 29.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 111.693 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.927 ' H ' HD13 ' B' ' 57' ' ' ILE . 5.0 t80 -135.11 64.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.16 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.939 HG13 HD11 ' B' ' 57' ' ' ILE . 26.7 m -101.75 148.11 7.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.145 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.774 HG21 HG21 ' B' ' 53' ' ' THR . 5.4 m -91.14 76.05 6.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.509 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 50.8 p-80 -55.1 169.69 0.23 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.463 ' C ' ' OG1' ' A' ' 70' ' ' THR . 0.5 OUTLIER -151.73 169.4 22.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.864 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.463 ' OG1' ' C ' ' A' ' 69' ' ' GLU . 0.3 OUTLIER 78.18 -101.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.052 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.673 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 179.03 28.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 1.092 ' HB2' ' HG3' ' A' ' 87' ' ' LYS . 32.6 m-70 -126.95 52.78 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.886 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 2.9 t80 -126.29 114.99 19.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.157 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.956 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.3 tt -126.4 137.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.895 0.379 . . . . 0.0 111.555 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.572 ' N ' ' O ' ' A' ' 10' ' ' ASN . 38.4 t80 -126.65 116.39 20.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.213 179.146 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.866 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -139.02 163.29 32.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.004 0.431 . . . . 0.0 111.456 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.627 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 25.8 t80 -121.17 93.41 4.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.499 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.028 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.3 mm? -43.78 172.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.645 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.488 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.82 -39.61 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.584 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.544 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.6 OUTLIER -153.52 21.55 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.956 0.408 . . . . 0.0 110.767 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.79 HG12 ' H ' ' A' ' 82' ' ' ALA . 28.5 t -134.91 177.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.898 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.996 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -137.95 153.33 49.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.805 0.336 . . . . 0.0 110.857 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.996 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.4 OUTLIER -143.49 120.91 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.254 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.036 HD23 HG13 ' A' ' 57' ' ' ILE . 13.2 tp -104.6 90.51 3.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.482 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.991 HD11 HG21 ' A' ' 42' ' ' ILE . 0.3 OUTLIER -95.47 141.92 28.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.648 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.886 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 47.0 p90 177.48 138.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.698 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 1.092 ' HG3' ' HB2' ' A' ' 72' ' ' HIS . 8.0 mtmt -97.44 174.11 6.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.66 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.919 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-O 121.309 0.576 . . . . 0.0 110.534 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.641 HH11 ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.744 0.307 . . . . 0.0 110.72 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.584 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 49.61 30.46 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.07 179.93 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.041 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -124.99 -166.89 1.59 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.145 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.526 ' N ' ' O ' ' B' ' 77' ' ' TYR . 57.8 t -151.18 73.84 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.957 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.955 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -41.04 159.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.093 0.473 . . . . 0.0 110.826 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.761 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 0.2 OUTLIER -155.04 -10.57 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.511 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.573 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.0 OUTLIER -164.6 84.79 0.42 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.34 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.821 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -123.53 88.99 3.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.881 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.611 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 10.8 t0 -87.6 25.35 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.26 0.552 . . . . 0.0 109.959 179.189 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.896 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.1 OUTLIER -110.96 166.84 10.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.656 -179.723 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.893 ' N ' ' HG2' ' B' ' 13' ' ' MET . 23.2 t -50.07 120.34 4.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.769 0.319 . . . . 0.0 110.731 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.877 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 3.2 mp0 -32.95 -67.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.178 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.459 ' H ' ' HG2' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -46.93 -44.99 20.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.674 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.896 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 31.7 mmm -61.23 -32.08 71.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.93 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -68.35 -43.16 78.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.878 179.87 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.488 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 2.9 mp0 -69.36 -33.87 73.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -71.4 -33.26 69.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.966 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.813 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.6 OUTLIER -67.94 -40.74 83.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.22 179.435 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.812 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 10.7 t -62.97 -46.12 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.376 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 29.8 mt-10 -62.58 -32.33 73.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.894 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.43 ' SG ' ' HD1' ' B' ' 46' ' ' PHE . 4.9 t -73.45 -36.44 65.9 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.908 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.956 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -69.27 -36.54 77.21 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.505 ' HA ' ' CD1' ' B' ' 29' ' ' LEU . 87.5 m -64.76 -42.79 94.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.618 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.631 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 12.8 mm100 -52.63 -48.67 66.22 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.803 179.093 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.812 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -59.83 -43.83 94.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.359 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.956 HD12 ' O ' ' B' ' 25' ' ' ALA . 0.9 OUTLIER -59.56 -60.57 3.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.806 179.824 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -48.57 -33.74 10.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.995 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 0.0 OUTLIER -85.28 -27.73 25.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.39 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.571 ' HE2' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -155.12 150.82 27.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.831 0.348 . . . . 0.0 111.226 -179.202 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.518 ' O ' HD13 ' B' ' 34' ' ' ILE . 35.6 t30 -115.36 47.07 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.95 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.887 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 42.0 mm -126.08 108.56 19.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.864 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.831 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 26.7 mp0 -29.53 -70.85 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.133 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.23 -49.11 61.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.766 0.317 . . . . 0.0 110.741 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.887 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.8 t0 -53.22 -64.27 0.87 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.862 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.842 HG21 ' HG ' ' B' ' 29' ' ' LEU . 11.6 mt -48.9 -43.74 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.691 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.98 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.32 -46.71 76.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.468 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.809 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -61.42 -67.27 0.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.496 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.797 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.7 OUTLIER -34.15 -40.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.538 179.44 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.868 HG21 HD11 ' B' ' 85' ' ' LEU . 33.9 mt -67.33 -50.91 58.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.298 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.712 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 6.1 tttt -55.33 -46.88 76.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.174 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -67.24 -36.83 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.209 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.596 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 8.5 mm-40 -68.45 -44.8 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.905 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.813 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -67.37 -35.27 79.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.678 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.833 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -66.79 -38.77 87.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.221 179.763 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.994 ' HE3' ' HA ' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.66 -18.21 25.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.111 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.649 ' HB3' ' HZ2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -88.75 -29.58 19.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.383 -179.573 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.624 ' HE2' ' CD1' ' B' ' 46' ' ' PHE . 7.0 m-85 -131.74 -57.16 0.99 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.533 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.606 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 27.4 t-20 157.23 119.36 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.11 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.418 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.833 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 20.3 Cg_endo -59.77 170.72 3.31 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.558 2.172 . . . . 0.0 112.255 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.774 HG21 HG21 ' A' ' 67' ' ' THR . 4.4 m -106.85 129.47 54.69 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 123.154 0.582 . . . . 0.0 110.475 0.136 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.714 ' CD2' ' HD2' ' B' ' 87' ' ' LYS . 58.0 m95 -101.74 116.81 33.54 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.83 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.0 OUTLIER -93.69 100.14 12.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.286 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.74 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.0 OUTLIER -108.54 148.62 30.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.305 0.574 . . . . 0.0 112.457 -178.005 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.978 ' CG1' HD23 ' B' ' 84' ' ' LEU . 19.5 mm -133.6 103.7 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.376 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 0.98 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.4 p -105.87 117.78 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.398 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.852 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -132.43 -104.88 0.94 Allowed Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.177 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.572 ' HD3' ' CG ' ' A' ' 61' ' ' ASN . 1.0 OUTLIER 179.67 -17.71 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.777 0.323 . . . . 0.0 111.131 -179.778 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.469 ' CG ' ' O ' ' B' ' 60' ' ' ARG . 22.0 m-20 177.78 41.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.833 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 27.6 p90 -87.61 -167.71 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -131.41 86.6 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.19 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.954 ' HA ' HG23 ' A' ' 57' ' ' ILE . 5.5 p -83.3 119.01 24.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 0.0 111.315 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.802 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 22.9 t80 -127.28 73.35 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.367 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.761 HG21 ' CE1' ' B' ' 86' ' ' PHE . 21.1 m -125.15 156.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.404 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.76 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 20.7 m -84.99 145.99 27.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.756 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.743 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -97.5 173.44 7.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.925 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.722 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 1.3 mm-40 -138.59 -114.92 0.15 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.12 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.582 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -47.29 -103.45 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.066 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.669 ' O ' ' HB2' ' B' ' 72' ' ' HIS . 1.3 mmtt -55.45 0.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.769 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 2.1 m170 76.77 -89.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.622 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.769 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 3.8 p90 163.46 155.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.986 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.93 HD12 ' CA ' ' B' ' 18' ' ' GLN . 1.1 tt -129.6 130.65 67.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.204 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.688 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -113.57 132.32 55.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.056 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.955 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.4 OUTLIER -158.21 152.54 24.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.966 0.412 . . . . 0.0 111.373 -179.45 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.582 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 1.0 OUTLIER -119.74 112.02 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.759 179.7 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.041 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -71.11 170.61 12.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.598 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.507 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.19 -55.93 0.06 OUTLIER Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.94 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -139.54 35.89 2.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.797 0.332 . . . . 0.0 111.035 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.852 HG13 ' O ' ' B' ' 59' ' ' GLY . 92.2 t -151.05 170.19 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 1.014 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -130.18 157.73 41.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.652 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 1.014 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -146.18 133.3 14.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.906 0.384 . . . . 0.0 111.537 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.978 HD23 ' CG1' ' B' ' 57' ' ' ILE . 0.5 OUTLIER -126.87 90.59 3.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.004 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.868 HD11 HG21 ' B' ' 42' ' ' ILE . 0.3 OUTLIER -90.74 130.74 36.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -178.975 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.761 ' CE1' HG21 ' B' ' 66' ' ' VAL . 1.6 p90 -169.15 120.97 0.75 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.833 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.745 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -87.67 162.99 16.79 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.909 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.83 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 3.0 m -115.87 19.25 15.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.184 0.516 . . . . 0.0 110.89 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.425 -1.208 . . . . 0.0 112.581 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.8 tttp . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.915 0.388 . . . . 0.0 111.121 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 59.41 175.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.34 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.741 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 3.8 t -144.59 73.05 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.546 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.993 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -43.24 130.2 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.883 0.373 . . . . 0.0 110.104 179.578 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.781 ' HE3' ' HB3' ' A' ' 77' ' ' TYR . 2.4 mmtp -120.91 -12.56 8.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.631 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.645 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 2.6 t30 -149.78 -92.1 0.07 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.383 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.883 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 67.21 -163.79 0.22 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.772 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.606 ' N ' ' O ' ' A' ' 73' ' ' PHE . 3.5 t0 169.34 31.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.967 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.891 ' SD ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -106.07 160.34 15.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.146 -179.439 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.573 ' O ' ' N ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -65.78 72.26 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.709 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 3.4 mt-10 32.92 -88.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.213 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 14' ' ' SER . 6.3 pt-20 -31.36 -32.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.108 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.741 ' HG3' ' CB ' ' A' ' 13' ' ' MET . 6.4 tpp -75.02 -45.53 41.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.054 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.759 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -63.22 -29.28 70.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 0.0 110.831 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -76.92 -45.07 29.22 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.76 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -68.68 -30.9 69.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.803 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.817 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.9 OUTLIER -64.55 -48.16 76.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.678 178.988 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.8 HG22 ' CD2' ' A' ' 76' ' ' PHE . 55.7 t -55.56 -50.48 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.183 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -52.88 -37.96 61.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.382 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.673 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 76.5 m -68.93 -36.85 78.46 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.147 0.499 . . . . 0.0 110.185 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.747 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.66 -30.06 67.65 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.771 ' HA ' HD12 ' A' ' 29' ' ' LEU . 94.8 m -74.08 -43.29 58.22 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.103 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.827 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.9 OUTLIER -52.66 -44.16 66.0 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.075 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 1.004 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -75.47 -26.58 58.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.205 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.921 HD11 ' HG ' ' A' ' 78' ' ' LEU . 3.6 mt -67.72 -44.93 76.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.374 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -81.0 -28.98 35.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.053 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.562 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.6 OUTLIER -77.43 -31.04 53.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.972 0.415 . . . . 0.0 110.92 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.642 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -160.82 138.86 9.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.511 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.638 ' HA ' HD11 ' A' ' 38' ' ' ILE . 2.6 m120 -100.97 27.84 5.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 0.0 110.627 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 50.4 mm -99.63 91.62 2.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.966 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.744 ' HG2' ' HA2' ' A' ' 59' ' ' GLY . 4.1 mp0 -23.25 -78.93 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.144 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.69 ' HD2' ' CG2' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.42 -42.3 3.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.899 179.725 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.77 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.3 t0 -63.61 -60.73 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.993 0.425 . . . . 0.0 110.583 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 1.004 HG23 ' HB3' ' A' ' 28' ' ' ALA . 41.0 mt -47.97 -40.23 8.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.409 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.999 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -69.31 -41.78 76.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.39 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.75 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -54.39 -57.46 11.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.225 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.623 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -59.17 -57.32 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.98 -179.874 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.747 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 91.8 mt -38.67 -45.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.337 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.729 ' HD3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -68.3 -59.61 3.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.019 -179.77 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.445 ' O ' ' OD2' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -43.76 -51.23 7.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.294 -179.656 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 5.0 tt0 -65.74 -49.31 68.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.991 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.817 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -58.21 -27.98 64.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.744 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -81.01 -34.11 33.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -98.75 5.95 47.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.125 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -126.44 -5.69 6.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.871 179.922 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.76 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 53.8 m-85 -136.82 -63.93 0.6 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.065 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.684 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 47.1 t30 160.82 110.59 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.38 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.744 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 35.1 Cg_exo -58.38 157.69 25.55 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.433 2.088 . . . . 0.0 112.478 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.96 HG23 ' CE1' ' A' ' 55' ' ' HIS . 11.1 t -108.84 139.0 44.27 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.932 0.493 . . . . 0.0 110.49 -0.101 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.828 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 62.2 m95 -101.9 121.14 41.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.2 0.524 . . . . 0.0 112.193 -178.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.96 ' CE1' HG23 ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.36 93.71 5.11 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.436 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.917 ' O ' HD13 ' A' ' 57' ' ' ILE . 1.6 p -112.78 161.7 16.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.323 0.583 . . . . 0.0 112.489 -178.008 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.964 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 21.9 mm -134.15 159.01 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.036 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.999 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.3 p -157.59 107.7 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.881 0.372 . . . . 0.0 111.531 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.744 ' HA2' ' HG2' ' A' ' 35' ' ' GLU . . . -143.58 -153.67 5.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.207 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.697 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.68 28.5 0.1 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.628 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.697 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 2.2 t-20 167.94 27.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.458 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.973 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -98.54 -157.24 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.978 179.721 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.584 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -154.85 81.17 0.17 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.118 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.799 ' HA ' HG12 ' B' ' 57' ' ' ILE . 74.0 p -66.69 161.2 23.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.012 0.435 . . . . 0.0 111.326 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.764 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 63.3 t80 -167.8 45.32 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.484 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.806 HG21 ' CE1' ' A' ' 86' ' ' PHE . 3.5 m -97.56 152.44 4.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.872 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.844 HG22 ' NE2' ' B' ' 55' ' ' HIS . 1.0 OUTLIER -96.96 147.96 23.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.995 -179.778 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.508 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -97.74 169.81 9.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.687 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.646 ' O ' HG23 ' A' ' 70' ' ' THR . 2.6 pt-20 -170.31 69.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.106 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.646 HG23 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 167.24 -110.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.231 179.822 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.706 ' O ' ' HA ' ' A' ' 13' ' ' MET . 20.5 pttm -162.19 6.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.662 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.845 ' HB2' ' HD3' ' A' ' 87' ' ' LYS . 0.9 OUTLIER -117.35 61.88 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.949 -179.981 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.724 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.3 t80 -133.69 94.77 3.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.746 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.891 ' HB ' ' SD ' ' A' ' 13' ' ' MET . 2.4 tt -110.18 134.82 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.304 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.645 ' HB3' ' HB3' ' A' ' 10' ' ' ASN . 3.4 t80 -127.15 88.86 2.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.231 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.993 ' HB3' HG13 ' A' ' 8' ' ' ILE . 3.1 p90 -114.86 174.35 6.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.36 -179.309 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.781 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 24.2 t80 -130.61 105.23 7.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.749 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.3 mm? -55.05 163.99 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.912 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.478 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.27 -47.38 0.18 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.54 20.09 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.709 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.782 HG12 ' H ' ' A' ' 82' ' ' ALA . 28.3 t -139.19 177.4 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.705 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.984 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -138.24 151.15 47.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.55 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.984 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.3 OUTLIER -141.89 122.04 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.957 0.408 . . . . 0.0 111.039 -179.696 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.964 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 4.7 tp -109.82 85.05 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.676 ' HG ' ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -87.84 137.91 31.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.806 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.6 p90 -179.26 132.01 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.373 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.845 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 1.2 mtpm? -102.49 -157.68 0.62 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.59 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.418 0 CA-C-O 121.319 0.58 . . . . 0.0 110.569 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.435 ' CD ' ' CD ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.847 0.356 . . . . 0.0 110.84 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 49.12 29.45 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.917 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.073 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -123.78 -168.3 1.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.302 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.641 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 40.2 t -153.46 76.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.209 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.771 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.4 mp -35.04 146.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.538 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.912 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 8.8 mmpt? -121.74 -23.39 5.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.376 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.422 ' HB3' ' H ' ' B' ' 11' ' ' ALA . 0.9 OUTLIER -153.11 -86.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.334 179.814 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.8 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 59.05 120.49 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.672 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.653 ' HB2' ' CE1' ' B' ' 73' ' ' PHE . 0.5 OUTLIER -117.75 25.12 10.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.261 0.553 . . . . 0.0 110.263 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.836 ' H ' HE22 ' B' ' 18' ' ' GLN . 14.0 ttp -108.45 169.78 8.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.756 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.718 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.8 OUTLIER -52.51 132.88 35.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.798 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.527 ' H ' ' HG3' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -42.73 -65.96 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.902 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -43.86 -34.12 1.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.807 ' SD ' ' HD3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -73.49 -32.72 64.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.942 ' O ' HG23 ' B' ' 22' ' ' VAL . 0.9 OUTLIER -68.48 -37.58 80.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.89 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.643 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -73.62 -38.35 65.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.35 -35.07 71.04 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.657 -0.702 . . . . 0.0 109.759 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.822 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -63.66 -40.82 97.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.844 179.131 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.942 HG23 ' O ' ' B' ' 18' ' ' GLN . 27.5 t -63.57 -44.6 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.304 179.312 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.643 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 51.5 mt-10 -57.59 -38.73 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.424 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.904 ' HB3' HG23 ' B' ' 42' ' ' ILE . 0.0 OUTLIER -67.82 -36.62 80.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.318 179.53 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.869 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.7 -30.08 65.28 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.424 ' HA ' HD12 ' B' ' 29' ' ' LEU . 11.4 m -73.29 -39.24 65.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.619 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.846 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -57.74 -43.7 85.56 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.404 178.826 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 1.008 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -68.8 -37.86 79.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.181 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.869 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -63.33 -39.5 94.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.779 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.16 -23.36 38.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.919 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.746 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -86.8 -25.36 24.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.811 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.6 ' CE1' ' HB3' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -157.63 175.1 14.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -133.62 38.4 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.081 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.918 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 5.0 mm -121.4 106.16 17.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.67 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.689 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 3.2 mp0 -29.52 -70.5 0.05 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.937 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.443 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.87 -37.84 14.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.622 179.603 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.918 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 20.0 t0 -66.92 -60.26 2.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 1.059 ' HB ' HG11 ' B' ' 58' ' ' VAL . 4.3 mt -47.71 -47.34 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.769 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.937 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.66 -50.37 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.636 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.764 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -56.44 -62.1 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.56 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.846 ' NE2' ' HB3' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -36.18 -55.02 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.234 179.436 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.904 HG23 ' HB3' ' B' ' 24' ' ' CYS . 16.3 mt -51.39 -69.98 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.089 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.827 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.0 OUTLIER -34.94 -63.34 0.32 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.414 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 0.3 OUTLIER -46.21 -41.63 13.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.114 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.783 ' HB3' ' SG ' ' B' ' 24' ' ' CYS . 2.0 tp10 -69.36 -44.16 72.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.89 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.822 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -65.9 -29.86 70.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.929 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.935 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.63 -40.56 66.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.693 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.528 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.12 -17.97 26.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.052 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.742 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.6 OUTLIER -88.34 -36.42 16.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.763 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.689 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 2.1 m-85 -123.46 -57.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.101 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.689 ' HB3' ' O ' ' B' ' 50' ' ' TYR . 5.9 p30 154.3 119.62 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.105 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.747 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.935 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 19.2 Cg_endo -59.09 168.49 4.56 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.254 1.969 . . . . 0.0 112.556 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.839 HG21 HG21 ' A' ' 67' ' ' THR . 1.2 t -112.7 119.16 37.13 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 122.726 0.41 . . . . 0.0 111.001 0.035 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.788 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 26.6 m95 -91.2 113.74 26.08 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.38 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.952 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 23.4 m170 -72.55 116.13 12.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.827 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 3.6 m -114.95 135.8 53.82 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.278 0.561 . . . . 0.0 112.438 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.799 HG12 ' HA ' ' A' ' 64' ' ' SER . 13.7 mt -139.98 104.92 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.02 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.059 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.8 p -112.52 125.81 69.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.684 -179.064 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.759 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -146.14 -131.33 2.25 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.682 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -165.69 -0.34 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 120.774 0.321 . . . . 0.0 111.091 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -173.96 34.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.973 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.8 p90 -93.67 163.42 13.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.675 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.726 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -118.15 80.27 0.31 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.815 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.91 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.0 p -77.9 128.02 33.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 111.368 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.75 ' CG ' ' HA ' ' A' ' 40' ' ' ALA . 25.2 t80 -136.85 68.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.348 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.887 HG13 HD11 ' A' ' 57' ' ' ILE . 29.8 m -111.58 151.81 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.107 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.918 HG21 HG21 ' A' ' 53' ' ' THR . 3.7 t -80.97 120.12 24.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.885 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.713 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -60.0 157.27 13.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.582 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 2.3 mt-10 -148.77 151.85 35.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.97 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.782 HG22 ' N ' ' B' ' 71' ' ' LYS . 42.2 m 57.63 -107.64 0.38 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.556 -179.676 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.807 ' HD3' ' SD ' ' B' ' 17' ' ' MET . 26.7 mttp -72.2 8.29 1.37 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.433 . . . . 0.0 110.375 179.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.772 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 24.8 m-70 79.6 -86.78 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.431 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.772 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 160.91 -175.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.745 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.898 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -158.13 117.58 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.099 179.626 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.82 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 13.2 t80 -108.15 139.21 43.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.605 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.807 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 1.3 p90 -160.32 169.98 22.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.608 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.636 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 23.5 t80 -132.02 113.83 13.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.073 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.4 mm? -70.93 169.43 14.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.781 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.51 -51.82 0.05 OUTLIER Glycine 0 C--N 1.333 0.372 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.845 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.468 ' O ' HG23 ' B' ' 81' ' ' VAL . 20.2 tt0 -143.25 41.61 1.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.81 0.338 . . . . 0.0 110.405 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.759 HG13 ' O ' ' B' ' 59' ' ' GLY . 60.4 t -157.9 169.9 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.189 -179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.653 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -135.12 141.74 46.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.329 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.825 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.2 OUTLIER -128.79 130.53 68.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.085 0.469 . . . . 0.0 111.939 -179.416 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.679 HD23 ' HB ' ' B' ' 57' ' ' ILE . 0.4 OUTLIER -117.33 97.88 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.791 HD11 HG21 ' B' ' 42' ' ' ILE . 1.2 mp -101.09 112.43 24.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.403 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.771 ' CE1' HG21 ' B' ' 66' ' ' VAL . 6.7 p90 -149.71 128.8 12.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.752 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.788 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 42.4 mtpt -93.4 170.12 9.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.296 -179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.952 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -119.2 19.27 12.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.638 179.728 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.459 -1.189 . . . . 0.0 112.544 -179.976 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.915 ' O ' HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.916 0.388 . . . . 0.0 110.859 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.101 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 81.47 152.29 0.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.437 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.629 HG12 ' O ' ' A' ' 7' ' ' VAL . 55.5 t -113.89 74.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.809 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.857 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -39.01 158.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.668 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -151.69 -8.92 0.22 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.764 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.538 ' O ' ' N ' ' A' ' 75' ' ' TYR . 1.3 m-20 -172.95 92.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.41 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.825 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -128.76 77.04 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.786 -179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.57 ' HB3' ' HB3' ' A' ' 72' ' ' HIS . 0.2 OUTLIER -73.72 26.94 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.064 179.104 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.873 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -111.84 171.24 7.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.564 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.873 ' N ' ' HG2' ' A' ' 13' ' ' MET . 18.9 m -56.47 151.56 13.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.767 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.689 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -56.26 -65.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.956 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.743 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -51.39 -25.23 5.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.768 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 68.1 mmm -78.77 -36.23 43.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.061 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 1.049 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -73.34 -36.81 66.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.702 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 37.0 mt-30 -74.74 -36.33 62.64 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.743 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -73.02 -31.72 64.65 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.678 178.918 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.79 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -64.77 -46.18 83.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.835 179.142 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.915 HG11 ' O ' ' A' ' 5' ' ' LYS . 97.2 t -60.06 -50.66 79.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.405 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.702 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 6.5 mt-10 -52.97 -37.94 61.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.364 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.19 -40.27 93.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.135 0.493 . . . . 0.0 110.056 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.799 ' C ' HD12 ' A' ' 29' ' ' LEU . . . -68.42 -33.39 74.14 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.728 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -71.51 -35.97 70.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.748 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.575 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 6.0 mt-30 -57.4 -42.96 83.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.373 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.998 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -85.93 -24.16 26.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 1.032 HD13 ' HG ' ' A' ' 78' ' ' LEU . 4.7 mt -75.51 -26.35 58.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.728 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.47 -35.27 11.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.607 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.575 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -83.96 -8.59 59.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.321 179.541 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.715 ' CE1' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -154.17 -174.57 5.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.791 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -154.57 26.2 0.45 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.569 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.083 ' HB ' ' HB3' ' A' ' 37' ' ' ASP . 11.5 mm -116.01 102.24 13.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.836 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.853 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 4.5 mp0 -25.28 -78.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.183 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.793 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -41.56 -46.24 3.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.703 179.63 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 1.083 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -58.03 -60.04 4.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.779 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.998 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 2.1 mt -48.61 -46.92 15.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.839 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 1.039 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.92 -53.14 61.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.04 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.691 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -42.16 -56.65 2.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.715 ' CD2' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -59.69 -57.04 14.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.907 -179.974 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.752 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 56.5 mt -42.9 -68.13 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.14 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.746 ' HB3' ' CD2' ' B' ' 65' ' ' TYR . 1.5 tmtt? -50.9 -34.85 30.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.94 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -68.94 0.26 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.861 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.593 ' O ' ' N ' ' A' ' 49' ' ' LYS . 39.8 mt-10 -48.23 -54.05 14.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.79 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.8 OUTLIER -45.9 -51.66 12.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.796 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.791 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -64.23 -23.35 67.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.172 -179.837 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.58 11.43 18.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.242 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.593 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -130.4 -8.62 4.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.743 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.665 ' HD1' ' HA ' ' A' ' 46' ' ' PHE . 84.0 m-85 -136.58 -63.5 0.62 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.85 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.558 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 1.4 m-20 157.25 117.98 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.258 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.791 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 20.6 Cg_endo -60.86 167.08 9.23 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.422 2.081 . . . . 0.0 112.42 -179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.779 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.0 OUTLIER -108.86 122.18 46.66 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.039 0.536 . . . . 0.0 110.803 0.046 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.816 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 36.5 m95 -93.48 149.92 20.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 112.034 -179.473 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.757 ' HD1' ' HB ' ' B' ' 66' ' ' VAL . 5.4 m-70 -127.37 103.49 7.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.418 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.871 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.6 OUTLIER -112.45 132.41 55.07 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.503 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.025 HG21 HG21 ' B' ' 57' ' ' ILE . 29.1 mm -120.24 107.17 20.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.167 178.755 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.039 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.8 p -107.5 131.21 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.966 0.412 . . . . 0.0 111.609 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.924 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.9 -142.79 3.52 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.817 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.441 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -160.21 3.58 0.08 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.743 0.272 . . . . 0.0 111.679 -179.856 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -177.4 31.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.422 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 1.071 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -92.37 -160.28 0.73 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.964 0.412 . . . . 0.0 110.983 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.736 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -152.72 78.59 0.2 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.034 -0.603 . . . . 0.0 111.941 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . 1.078 ' HB2' HD12 ' B' ' 57' ' ' ILE . 25.6 p -72.9 140.27 47.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.972 0.415 . . . . 0.0 111.142 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.818 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 61.2 t80 -152.68 84.17 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.513 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.869 HG21 ' CE1' ' A' ' 86' ' ' PHE . 3.2 m -132.21 168.08 24.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.282 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' THR . . . . . 1.01 HG21 HG21 ' B' ' 53' ' ' THR . 1.3 t -83.78 -178.48 7.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.616 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.755 ' CD2' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -130.13 153.03 48.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.705 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.957 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 5.3 mm-40 -127.05 -124.61 0.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.272 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.545 ' OG1' ' HE2' ' A' ' 87' ' ' LYS . 11.2 p -31.11 -99.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.779 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.701 ' O ' ' HB2' ' A' ' 13' ' ' MET . 3.0 mmtp -73.18 27.61 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.093 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.772 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 21.1 m-70 62.05 -90.63 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.772 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER 161.66 158.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.503 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 1.049 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -127.77 134.7 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.023 0.44 . . . . 0.0 111.301 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.788 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 1.4 t80 -124.79 138.84 54.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.161 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.861 ' CD2' HG22 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -163.65 164.45 23.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.876 0.37 . . . . 0.0 111.032 -179.692 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.981 ' HD1' ' HB2' ' A' ' 82' ' ' ALA . 74.6 t80 -127.49 94.52 4.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.081 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.101 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.6 mm? -44.05 158.21 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.855 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.455 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.92 -28.91 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.639 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' A' ' 78' ' ' LEU . 13.5 pt20 -153.13 33.41 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.918 0.39 . . . . 0.0 110.946 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.966 HG11 HD21 ' A' ' 29' ' ' LEU . 72.6 t -156.48 170.89 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.981 ' HB2' ' HD1' ' A' ' 77' ' ' TYR . . . -136.56 119.05 15.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.858 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.823 HD11 HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -111.6 129.33 67.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.003 0.43 . . . . 0.0 111.612 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 1.012 HD22 ' HB2' ' A' ' 64' ' ' SER . 0.6 OUTLIER -116.22 92.0 3.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.279 179.647 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.871 HD12 ' HB3' ' A' ' 56' ' ' CYS . 3.1 mp -92.85 135.15 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.003 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.869 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.4 p90 -171.65 121.14 0.49 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.058 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.816 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 1.8 ptmt -104.53 143.16 33.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.785 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.957 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 110.814 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.949 HH21 HD13 ' B' ' 8' ' ' ILE . 7.8 tpt180 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 121.004 0.431 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.671 ' O ' HD13 ' B' ' 78' ' ' LEU . 13.3 tttt -30.62 111.62 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.935 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.98 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 160.74 -172.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.853 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.779 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 53.0 t -150.36 71.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.813 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.961 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.84 143.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.973 -179.803 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.779 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 8.8 mmpt? -112.17 -28.41 7.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.923 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.618 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 4.0 t-20 -157.5 -91.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.241 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.806 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 78.44 97.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.066 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.2 t0 -90.47 29.84 1.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.18 0.514 . . . . 0.0 109.975 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.921 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.0 OUTLIER -116.25 153.26 32.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.606 -179.66 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.755 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -37.0 154.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.693 ' HA ' HE21 ' B' ' 18' ' ' GLN . 0.0 OUTLIER -61.79 -68.22 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.794 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -48.3 -24.06 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.666 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.921 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -76.88 -42.56 39.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.851 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 1.1 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -65.32 -29.15 69.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.035 0.445 . . . . 0.0 110.252 179.525 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.505 ' NE2' ' HD3' ' B' ' 4' ' ' ARG . 4.3 mm100 -77.59 -43.26 32.23 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.28 0.562 . . . . 0.0 109.598 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.617 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.9 OUTLIER -69.78 -27.69 65.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.682 178.895 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.804 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 2.5 t -68.04 -49.56 60.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.928 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.908 HG22 ' CD2' ' B' ' 76' ' ' PHE . 76.7 t -55.77 -46.54 79.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.156 179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.53 -40.26 86.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.023 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.626 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 1.3 m -66.68 -34.28 77.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.759 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.829 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.45 -32.26 68.11 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.243 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.522 ' HA ' HD12 ' B' ' 29' ' ' LEU . 12.4 m -70.94 -41.25 71.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.142 -1.39 . . . . 0.0 109.858 178.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.797 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 33.8 mm-40 -55.83 -46.9 78.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.752 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 1.002 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -65.58 -34.39 78.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.403 179.239 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.829 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -66.21 -50.18 64.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.16 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 30' ' ' GLU . . . . . 0.683 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -66.7 -27.59 67.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.013 -179.811 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.797 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 28.0 mmtp -85.68 -26.81 25.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.89 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.573 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -157.33 151.78 25.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.729 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.679 ' C ' HD13 ' B' ' 34' ' ' ILE . 1.5 p30 -113.28 36.37 3.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.903 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.83 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.6 mm -118.98 108.72 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.932 ' HA ' HD12 ' B' ' 38' ' ' ILE . 54.7 mm-40 -29.7 -71.08 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.024 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.465 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.1 OUTLIER -46.32 -45.99 17.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.895 0.379 . . . . 0.0 110.646 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.83 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 15.0 t0 -58.92 -61.28 2.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.85 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 1.002 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 2.1 mt -43.93 -47.75 2.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.816 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 1.042 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -57.14 -59.43 5.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.529 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -45.63 -61.57 1.65 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.779 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.9 OUTLIER -41.62 -49.04 4.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.264 179.387 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.666 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 18.8 mt -61.51 -68.64 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.815 ' HE2' ' HB3' ' B' ' 47' ' ' ASP . 1.4 tptm -39.62 -27.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.689 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -75.98 -60.34 2.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.0 0.429 . . . . 0.0 110.858 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.736 ' HG2' ' O ' ' B' ' 41' ' ' HIS . 0.4 OUTLIER -60.56 -25.88 66.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.04 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.804 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -76.86 -48.04 19.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.419 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.815 ' HB3' ' HE2' ' B' ' 43' ' ' LYS . 3.2 p30 -64.21 -27.17 68.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.274 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.439 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -90.03 -41.61 11.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.029 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.68 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -79.04 -20.02 49.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.048 -179.632 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.685 ' CD1' ' HA ' ' B' ' 46' ' ' PHE . 8.9 m-85 -128.66 -70.03 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.452 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.667 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 36.5 t30 157.38 117.58 0.0 OUTLIER Pre-proline 0 CA--C 1.529 0.163 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.479 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.8 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 30.1 Cg_endo -63.01 170.1 8.03 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.369 2.046 . . . . 0.0 112.526 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 53' ' ' THR . . . . . 1.01 HG21 HG21 ' A' ' 67' ' ' THR . 0.6 OUTLIER -103.54 132.49 49.74 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 122.822 0.449 . . . . 0.0 110.544 0.041 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.774 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 46.4 m95 -101.62 104.66 15.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.574 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.849 ' HE1' HG22 ' A' ' 67' ' ' THR . 37.1 m-70 -69.42 90.71 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 23.8 p -105.06 123.73 48.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.059 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 1.078 HD12 ' HB2' ' A' ' 64' ' ' SER . 19.0 mm -118.08 108.28 24.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.088 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.042 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.4 p -111.07 120.91 62.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.868 0.366 . . . . 0.0 111.369 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.639 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.77 -136.09 3.47 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.063 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.575 ' O ' ' ND2' ' B' ' 61' ' ' ASN . 0.4 OUTLIER -162.67 5.61 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 120.873 0.368 . . . . 0.0 111.13 -179.568 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.575 ' ND2' ' O ' ' B' ' 60' ' ' ARG . 0.5 OUTLIER 171.18 31.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 1.071 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -89.29 -170.4 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.024 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.853 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -139.46 76.92 0.33 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.081 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.979 ' CB ' HD12 ' A' ' 57' ' ' ILE . 9.6 p -69.66 138.12 52.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.012 0.434 . . . . 0.0 111.191 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.763 ' H ' HD13 ' A' ' 57' ' ' ILE . 68.3 t80 -146.24 88.55 1.8 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.828 HG21 ' CE1' ' B' ' 86' ' ' PHE . 10.2 m -125.74 145.68 32.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.348 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.779 HG21 ' CG2' ' A' ' 53' ' ' THR . 0.0 OUTLIER -80.13 70.05 6.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.632 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.428 ' N ' ' CD2' ' B' ' 68' ' ' HIS . 0.3 OUTLIER -51.24 160.91 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.733 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' B' ' 71' ' ' LYS . 0.8 OUTLIER -156.84 -144.75 0.14 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.768 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.528 ' OG1' ' N ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 39.99 -90.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.729 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.5 OUTLIER 163.21 21.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 179.938 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.495 ' HB3' ' CZ3' ' B' ' 54' ' ' TRP . 39.6 m80 -115.96 52.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.765 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.867 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.9 t80 -127.34 123.92 37.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 1.1 HG13 ' HB3' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -135.42 117.36 20.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.537 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.566 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -103.35 134.74 46.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.007 178.972 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.961 ' HE1' HG23 ' B' ' 74' ' ' ILE . 0.5 OUTLIER -162.68 169.15 20.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.902 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.568 ' O ' ' N ' ' B' ' 7' ' ' VAL . 49.4 t80 -135.38 115.77 13.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.756 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 0.98 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -68.77 169.99 10.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.763 -179.769 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.427 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -35.09 -35.46 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.742 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' B' ' 78' ' ' LEU . 1.4 pt20 -154.38 33.8 0.42 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.823 0.344 . . . . 0.0 111.134 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.63 HG12 ' N ' ' B' ' 82' ' ' ALA . 55.3 t -152.83 168.22 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.613 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.918 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -131.62 152.29 50.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.819 0.343 . . . . 0.0 111.111 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.918 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -141.95 123.77 13.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.393 -179.628 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.924 HD23 HG12 ' B' ' 57' ' ' ILE . 0.4 OUTLIER -117.89 90.2 3.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.404 179.756 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.78 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -94.64 130.78 40.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.618 -179.442 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.867 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 16.8 p90 -169.01 132.53 1.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.476 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.774 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 1.2 mtpp -108.16 170.47 7.98 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.733 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.449 ' OG ' ' CB ' ' A' ' 88' ' ' SER . 0.2 OUTLIER -122.01 19.89 10.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.306 0.574 . . . . 0.0 110.998 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.426 -1.208 . . . . 0.0 112.598 -179.919 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.592 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 22.3 tptm . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.865 0.364 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.976 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.28 173.7 9.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.406 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.742 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 38.5 t -132.7 81.32 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.674 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.873 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -50.32 150.62 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.978 0.418 . . . . 0.0 110.505 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.762 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -159.42 1.11 0.08 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.787 -179.771 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.821 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 2.4 t-20 -160.25 77.55 0.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.553 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.683 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.06 174.35 6.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.232 0.539 . . . . 0.0 111.879 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.678 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -174.03 28.51 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.398 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.86 ' H ' HE22 ' A' ' 18' ' ' GLN . 16.0 ttp -124.45 171.15 10.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.688 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.706 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.4 OUTLIER -53.57 138.24 34.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.656 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -43.95 -67.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.52 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -48.15 -34.13 9.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.94 -179.994 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.744 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 47.2 mmm -68.92 -29.83 68.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.862 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.981 ' HA ' HD12 ' A' ' 74' ' ' ILE . 1.6 mm100 -74.21 -39.09 63.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.654 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.739 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 6.9 mt-30 -74.83 -34.23 62.3 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.3 OUTLIER -73.53 -36.86 65.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.642 178.988 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.971 ' HB2' HD22 ' A' ' 85' ' ' LEU . 56.6 p -62.91 -47.38 83.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.835 178.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.972 HG23 ' O ' ' A' ' 18' ' ' GLN . 26.3 t -57.64 -49.97 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.739 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 40.9 mt-10 -55.14 -38.57 68.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.213 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.69 -37.39 84.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.187 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.717 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -70.93 -27.83 64.05 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 178.517 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 5.3 m -73.85 -39.99 63.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.355 178.472 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.59 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -56.51 -45.36 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.629 178.971 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.878 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -75.3 -23.38 57.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.752 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 1.062 HD21 HG11 ' A' ' 81' ' ' VAL . 7.0 mt -73.94 -34.02 64.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -94.17 -21.75 18.88 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.533 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.614 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 41.0 mmtm -90.1 -13.16 36.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.676 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.681 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -152.26 -142.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.61 ' HA ' HD11 ' A' ' 38' ' ' ILE . 7.9 m-20 159.88 34.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.501 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.949 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 33.2 mm -113.97 39.21 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.184 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.787 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.6 mp0 36.69 -87.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.58 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.677 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.06 -43.42 3.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.378 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.949 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.9 t70 -60.45 -57.62 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.335 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.878 HG23 ' HB3' ' A' ' 28' ' ' ALA . 3.2 mt -48.3 -55.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.856 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -53.1 -46.65 68.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.88 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.717 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -52.03 -54.56 28.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.054 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.552 ' HD1' ' HB1' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -60.82 -55.21 35.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.737 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.748 HD11 HG22 ' A' ' 38' ' ' ILE . 76.3 mt -44.31 -56.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.137 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.84 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.2 OUTLIER -53.42 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.754 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.579 ' HA ' ' OD2' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -35.61 -53.81 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.565 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.2 mm-40 -51.37 -58.94 4.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.78 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.743 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 3.0 m-85 -52.35 -48.6 65.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.786 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.801 ' HB2' ' HB3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -61.54 -19.25 61.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.653 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.34 12.3 10.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.0 OUTLIER -124.44 -16.87 6.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.096 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.701 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 27.1 m-85 -140.1 -55.36 0.54 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.801 0.334 . . . . 0.0 111.238 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.701 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 3.5 t30 160.1 119.77 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.169 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.314 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.801 ' HB3' ' HB2' ' A' ' 47' ' ' ASP . 39.4 Cg_endo -67.02 166.87 21.47 Favored 'Trans proline' 0 CA--C 1.532 0.399 0 C-N-CA 122.464 2.109 . . . . 0.0 112.344 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.811 HG22 ' CE1' ' A' ' 55' ' ' HIS . 3.7 m -106.64 128.28 54.04 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 122.817 0.447 . . . . 0.0 110.77 0.173 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.796 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.7 m95 -94.64 123.38 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.856 -179.523 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.892 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.0 OUTLIER -106.9 97.69 7.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.588 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.882 ' HB2' HD12 ' A' ' 85' ' ' LEU . 27.7 p -117.5 162.37 18.09 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.93 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 16.5 mm -129.47 168.48 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.01 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.9 p -165.04 110.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.899 0.38 . . . . 0.0 111.479 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.792 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -146.48 -128.14 1.9 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.205 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.564 ' HG3' ' NH1' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -167.14 -37.67 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.785 0.326 . . . . 0.0 111.121 -179.755 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -140.16 52.61 1.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.247 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 1.053 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.4 OUTLIER -110.11 168.46 9.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.374 . . . . 0.0 110.758 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.901 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -115.1 81.31 0.3 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.959 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.927 ' HA ' HG12 ' B' ' 57' ' ' ILE . 1.0 OUTLIER -76.06 137.95 40.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.968 0.414 . . . . 0.0 111.472 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.742 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 9.1 t80 -151.16 65.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.42 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.678 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 28.5 m -112.78 161.74 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.187 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.767 HG23 ' N ' ' A' ' 68' ' ' HIS . 2.8 t -81.65 -149.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.952 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.767 ' N ' HG23 ' A' ' 67' ' ' THR . 5.7 p-80 179.59 161.2 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.711 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -161.64 165.07 28.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.041 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.456 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 9.1 m 68.72 -93.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.126 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER 168.3 67.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.858 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 95.9 m-70 -154.73 16.73 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.988 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 8.8 t80 -99.4 101.0 12.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.37 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.981 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -123.56 118.87 55.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.958 0.408 . . . . 0.0 111.595 -179.898 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.821 ' HB3' ' HB3' ' A' ' 10' ' ' ASN . 75.9 t80 -112.76 135.03 53.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.111 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.873 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -150.13 176.55 10.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.877 0.37 . . . . 0.0 111.203 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.778 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 7.2 t80 -132.4 99.45 4.68 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.19 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.976 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.9 mm? -65.24 -174.83 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.329 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.46 ' O ' ' CB ' ' A' ' 80' ' ' GLN . . . -60.18 85.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.062 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.778 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 5.7 tt0 82.68 12.31 0.52 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.807 0.337 . . . . 0.0 110.739 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 1.062 HG11 HD21 ' A' ' 29' ' ' LEU . 68.5 t -136.09 173.58 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.853 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.807 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -148.99 154.67 39.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.858 0.361 . . . . 0.0 111.142 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.807 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.4 OUTLIER -139.95 116.08 8.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.037 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.93 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 12.6 tp -97.98 86.52 3.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.785 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.971 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -90.48 139.24 30.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.051 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.988 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.0 OUTLIER -172.53 121.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.355 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.857 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.8 OUTLIER -94.21 118.99 32.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.792 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.864 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-O 121.311 0.576 . . . . 0.0 110.784 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.674 ' HD2' ' OE1' ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.772 0.32 . . . . 0.0 110.765 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -89.99 36.08 0.86 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.073 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.071 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -110.52 -155.33 0.56 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.055 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.563 ' N ' ' O ' ' B' ' 77' ' ' TYR . 6.8 t -158.36 67.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.134 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.896 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.1 mp -35.66 142.84 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 110.153 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 1.008 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 5.2 mmpt? -120.86 -22.41 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.467 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 38.1 t-20 -150.21 -104.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.308 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.755 ' CB ' ' HA ' ' B' ' 74' ' ' ILE . . . 69.25 145.34 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.176 0.512 . . . . 0.0 111.743 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.565 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -145.17 25.49 1.39 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.647 179.216 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.648 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 20.1 ttp -102.04 166.47 10.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.989 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.733 ' HB2' ' HG3' ' B' ' 17' ' ' MET . 2.2 m -47.68 143.52 3.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.814 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 3.4 pt-20 -49.84 -69.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.864 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.761 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -47.34 -21.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.763 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.733 ' HG3' ' HB2' ' B' ' 14' ' ' SER . 0.0 OUTLIER -82.39 -37.73 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.017 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 0.99 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.26 -34.72 68.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.659 179.869 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.674 ' OE1' ' HD2' ' B' ' 4' ' ' ARG . 37.7 mt-30 -77.86 -40.42 40.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.927 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.761 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -69.15 -33.44 73.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.638 179.161 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.869 ' HB2' HD22 ' B' ' 85' ' ' LEU . 0.6 OUTLIER -65.48 -49.28 69.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.154 179.286 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.984 HG22 ' CD2' ' B' ' 76' ' ' PHE . 84.1 t -59.94 -37.11 70.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.162 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 23' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 62.2 mt-10 -63.86 -35.05 79.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.344 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.502 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 3.5 t -72.82 -34.61 66.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 109.798 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.741 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -72.63 -35.04 67.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.328 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.924 ' HA ' HD12 ' B' ' 29' ' ' LEU . 51.7 m -69.83 -43.89 71.05 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.622 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.813 ' HG3' ' N ' ' B' ' 28' ' ' ALA . 0.9 OUTLIER -52.73 -46.84 67.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.526 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.813 ' N ' ' HG3' ' B' ' 27' ' ' GLN . . . -71.28 -24.14 62.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.721 178.793 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.924 HD12 ' HA ' ' B' ' 26' ' ' THR . 3.5 mt -71.34 -36.82 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.543 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -86.74 -28.83 22.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.625 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.779 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 44.7 mmtm -84.25 -27.61 27.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.766 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -148.87 164.49 34.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.662 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.49 ' C ' HD13 ' B' ' 34' ' ' ILE . 9.7 m120 -129.65 31.25 4.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 1.053 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.2 mm -113.7 107.1 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.901 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 13.9 mp0 -31.15 -67.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.545 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -48.57 -60.69 2.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.789 179.594 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 1.053 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.2 m-20 -45.29 -65.1 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.664 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.829 ' HB ' HG11 ' B' ' 58' ' ' VAL . 9.9 mt -41.91 -46.74 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.127 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 1.047 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -64.88 -42.46 94.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.984 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.742 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -57.85 -59.44 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.156 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.697 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -53.53 -55.06 28.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.661 179.985 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.81 HD11 HG22 ' B' ' 38' ' ' ILE . 37.7 mt -45.5 -69.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.698 ' HD2' ' HE2' ' A' ' 65' ' ' TYR . 4.4 tmtt? -45.21 -36.45 3.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.898 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.511 ' O ' ' HE2' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -65.94 -50.01 65.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.977 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.769 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.8 OUTLIER -64.86 -35.88 82.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.912 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.798 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -68.61 -40.52 80.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.029 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.78 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.43 -39.07 85.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.899 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -32.37 34.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.769 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.82 -13.28 39.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.776 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.722 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 98.6 m-85 -123.58 -73.23 0.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.48 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.722 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 60.3 t30 159.21 113.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.172 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.78 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 78.5 Cg_exo -42.13 151.06 0.21 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.208 1.939 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.759 HG23 ' CE1' ' B' ' 55' ' ' HIS . 2.8 t -122.41 131.84 54.08 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 122.895 0.478 . . . . 0.0 110.51 0.086 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 1.019 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 53.3 m95 -96.16 126.01 41.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.716 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.759 ' CE1' HG23 ' B' ' 53' ' ' THR . 0.0 OUTLIER -98.13 94.08 6.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.092 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 1.039 ' HB3' HD12 ' B' ' 85' ' ' LEU . 1.8 m -112.61 169.68 8.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.437 0.637 . . . . 0.0 112.015 -177.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.935 HD12 HD23 ' B' ' 84' ' ' LEU . 32.8 mt -158.34 162.19 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.346 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.047 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.2 p -159.54 114.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.003 0.43 . . . . 0.0 111.488 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.816 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -143.2 -133.92 2.82 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.942 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.404 ' H ' ' H ' ' B' ' 61' ' ' ASN . 5.3 ptm180 -172.88 10.03 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.778 0.323 . . . . 0.0 111.168 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.44 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -174.62 32.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.216 -179.908 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 1.053 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 8.8 p90 -102.81 168.34 9.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.05 0.452 . . . . 0.0 111.142 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -121.79 81.84 0.35 Allowed Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.064 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.923 ' HA ' HG23 ' A' ' 57' ' ' ILE . 8.7 p -75.88 123.27 25.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.959 0.409 . . . . 0.0 111.324 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.84 ' HE2' ' HD2' ' A' ' 43' ' ' LYS . 10.8 t80 -134.85 68.88 1.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.507 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.904 HG21 ' CE1' ' B' ' 86' ' ' PHE . 4.6 m -114.88 150.99 16.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.457 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 16.3 m -87.37 95.99 10.2 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.857 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.807 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 10.6 p-80 -61.87 159.08 14.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.573 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -152.65 -171.6 3.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.614 179.98 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.593 HG22 ' HG2' ' B' ' 71' ' ' LYS . 29.8 m 51.68 -119.54 1.47 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.413 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.593 ' HG2' HG22 ' B' ' 70' ' ' THR . 55.5 mmtt -72.95 31.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 0.0 110.202 179.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.807 ' O ' ' HB2' ' B' ' 68' ' ' HIS . 63.2 m-70 61.49 -93.67 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.496 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.793 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 159.4 -161.06 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.99 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.5 OUTLIER -165.3 111.66 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.049 179.24 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.549 ' HE1' ' HZ ' ' B' ' 62' ' ' PHE . 9.6 t80 -110.12 98.27 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.984 ' CD2' HG22 ' B' ' 22' ' ' VAL . 3.6 p90 -118.58 169.67 9.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.67 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 31.2 t80 -132.27 113.21 12.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.522 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.071 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -70.39 169.87 13.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.73 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.516 ' C ' ' HG2' ' B' ' 80' ' ' GLN . . . -24.76 -47.63 0.02 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.117 -0.564 . . . . 0.0 113.218 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.516 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -145.71 29.83 1.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.644 0.259 . . . . 0.0 111.142 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.816 HG13 ' O ' ' B' ' 59' ' ' GLY . 97.1 t -143.61 170.11 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.285 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.771 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -137.1 126.09 24.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.552 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.658 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.3 OUTLIER -114.66 124.05 70.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.134 0.493 . . . . 0.0 111.832 -179.399 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.935 HD23 HD12 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -106.85 93.96 4.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.039 179.655 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 1.039 HD12 ' HB3' ' B' ' 56' ' ' CYS . 0.5 OUTLIER -100.43 122.86 43.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.276 -179.414 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.904 ' CE1' HG21 ' B' ' 66' ' ' VAL . 18.3 p90 -163.83 115.06 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.319 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 1.019 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 5.6 ptmt -105.02 158.32 16.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.684 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.573 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.6 OUTLIER -95.52 19.45 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.229 0.538 . . . . 0.0 110.869 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 89' ' ' GLY . . . . . 0.745 ' HA2' ' CE ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.47 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.62 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.862 0.363 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.045 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -141.67 173.34 11.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.244 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.47 ' HB ' ' HB3' ' A' ' 77' ' ' TYR . 39.0 t -139.05 75.78 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.033 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.828 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -38.89 160.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.13 0.49 . . . . 0.0 110.637 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.734 ' HD3' ' O ' ' A' ' 8' ' ' ILE . 2.8 mmtp -159.44 -6.96 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.63 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.477 ' CG ' ' HZ ' ' A' ' 73' ' ' PHE . 19.7 t30 -167.51 71.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.393 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.877 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -117.5 92.36 3.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.664 -179.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.811 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 53.7 m-20 -90.53 26.41 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.154 0.502 . . . . 0.0 110.246 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.775 ' HG3' ' H ' ' A' ' 14' ' ' SER . 16.0 ttp -109.85 173.33 6.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.775 ' H ' ' HG3' ' A' ' 13' ' ' MET . 1.2 t -57.91 140.85 51.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.86 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.571 ' HA ' ' CG ' ' A' ' 18' ' ' GLN . 11.9 mt-10 -47.98 -62.91 1.23 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.967 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 1.1 mt-10 -51.68 -31.62 26.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.566 ' SD ' ' HD3' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -72.57 -45.59 58.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 1.007 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -62.4 -36.86 83.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.943 179.957 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.549 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 4.9 mt-30 -73.57 -35.17 65.43 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.483 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -74.05 -27.74 61.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.699 178.917 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.829 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.4 t -71.22 -41.03 70.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.06 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.958 HG22 ' CD2' ' A' ' 76' ' ' PHE . 94.7 t -65.58 -46.67 88.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.613 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.719 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 58.2 mt-10 -57.97 -41.7 83.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.114 179.399 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 20.3 m -64.35 -37.04 86.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.758 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.891 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -69.99 -32.56 70.82 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 22' ' ' VAL . 1.6 m -69.27 -38.82 78.56 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.47 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.775 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 57.5 mt-30 -59.22 -41.01 87.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.943 179.289 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.99 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -73.21 -31.72 64.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.132 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.891 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.3 mt -72.13 -35.68 69.18 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.327 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -93.17 -11.78 31.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.352 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.775 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 8.4 mttm -96.43 -19.82 18.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.723 0.297 . . . . 0.0 111.216 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.594 ' HE1' ' ND1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -151.46 -62.77 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.031 179.955 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.935 ' HA ' HD11 ' A' ' 38' ' ' ILE . 5.7 t-20 74.83 61.12 0.07 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.75 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.057 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 44.3 mm -141.21 57.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.011 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.617 ' O ' HG13 ' A' ' 58' ' ' VAL . 1.5 mp0 31.87 -91.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.974 0.416 . . . . 0.0 110.266 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.673 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -44.02 -54.03 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.214 179.105 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 1.057 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -52.26 -58.29 7.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.978 179.632 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.99 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 24.5 mt -48.22 -43.42 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.939 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.896 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -62.22 -49.62 75.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.765 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.815 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -53.26 -45.74 68.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.776 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.827 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -57.2 -58.44 8.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.622 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.917 HG21 HD11 ' A' ' 85' ' ' LEU . 8.0 mt -50.42 -74.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.367 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.721 ' HD3' ' CD2' ' B' ' 65' ' ' TYR . 7.6 tttt -39.11 -40.62 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.799 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.587 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.21 -62.36 1.7 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.038 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -60.48 -58.95 6.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.871 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.829 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.9 OUTLIER -42.02 -38.19 1.57 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.769 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -69.35 -43.74 73.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.837 -179.855 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.998 ' HE3' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -95.94 9.78 39.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.316 -179.844 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -129.96 -5.54 4.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.119 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.793 ' HD1' ' HA ' ' A' ' 46' ' ' PHE . 75.9 m-85 -138.39 -61.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.224 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.5 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.7 OUTLIER 158.8 109.62 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.223 -179.708 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.769 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 51.7 Cg_exo -54.23 148.81 39.26 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.39 2.06 . . . . 0.0 112.734 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.892 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.2 OUTLIER -117.42 144.12 45.31 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.882 0.473 . . . . 0.0 110.731 -0.021 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.651 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 70.7 m95 -101.19 114.88 29.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.499 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.807 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -86.3 92.31 8.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.812 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 1.055 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.4 OUTLIER -106.81 144.36 33.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.233 0.539 . . . . 0.0 112.293 -178.412 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.046 HD11 HG13 ' B' ' 66' ' ' VAL . 14.5 mm -132.81 107.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.341 179.02 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.896 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.1 p -107.47 129.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.954 0.407 . . . . 0.0 111.479 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.764 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.98 -127.07 1.06 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.057 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.508 ' O ' ' HE2' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -160.56 -54.48 0.05 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 120.746 0.307 . . . . 0.0 111.23 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.814 ' HB3' ' CZ ' ' B' ' 60' ' ' ARG . 1.6 m-20 -130.94 67.54 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.084 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.814 ' HE2' ' HB3' ' A' ' 64' ' ' SER . 1.4 p90 -122.57 -166.02 1.37 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.872 0.368 . . . . 0.0 110.861 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.601 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -138.07 75.51 0.38 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.029 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.814 ' HA ' HG23 ' B' ' 57' ' ' ILE . 73.8 p -67.86 133.71 49.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.828 0.347 . . . . 0.0 111.177 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.877 ' HD2' ' HG2' ' B' ' 43' ' ' LYS . 16.1 t80 -151.42 79.54 1.29 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.897 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.955 HG21 ' CD1' ' A' ' 86' ' ' PHE . 21.2 m -110.09 176.67 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.039 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.786 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 55.1 m -107.01 108.97 20.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.83 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.625 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -57.89 157.39 7.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 179.938 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.725 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 9.9 mm-40 -136.96 -125.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.923 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.482 ' O ' ' O ' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -30.18 -97.61 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.225 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.566 ' HD3' ' SD ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -78.94 46.55 0.7 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.521 -179.972 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.811 ' ND1' ' HB3' ' A' ' 12' ' ' ASP . 18.8 m170 47.48 -90.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.623 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.749 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 4.7 p90 163.13 -160.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.594 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 1.007 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -168.08 129.8 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.581 179.743 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 15.4 t80 -123.19 136.14 54.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.612 178.718 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.958 ' CD2' HG22 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -154.57 168.87 25.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.996 0.427 . . . . 0.0 111.193 -179.314 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.704 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 11.7 t80 -127.1 99.09 5.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.187 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.045 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -65.91 -175.06 0.27 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 179.76 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.451 ' O ' ' HB3' ' A' ' 80' ' ' GLN . . . -58.11 86.78 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.978 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.451 ' HB3' ' O ' ' A' ' 79' ' ' GLY . 48.0 tt0 78.01 23.25 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 0.0 110.195 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.764 HG13 ' O ' ' A' ' 59' ' ' GLY . 45.5 t -141.97 167.13 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.782 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.806 ' HB3' ' HE1' ' A' ' 62' ' ' PHE . . . -146.43 118.58 8.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.795 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -105.11 139.99 24.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.973 0.416 . . . . 0.0 111.609 -179.53 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.974 HD23 HG12 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -124.7 94.53 4.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.378 179.644 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 1.055 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -99.6 129.14 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.556 -179.318 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.955 ' CD1' HG21 ' A' ' 66' ' ' VAL . 1.4 p90 -166.32 119.37 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.909 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.651 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -105.82 151.79 24.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.067 -179.949 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.725 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.175 0.512 . . . . 0.0 110.809 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.578 ' NH1' ' HG3' ' B' ' 4' ' ' ARG . 3.2 mmm-85 . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.825 0.345 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.662 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.0 OUTLIER 77.62 98.27 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.689 -179.869 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 1.051 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.03 -168.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.767 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.691 ' CG1' ' HE2' ' B' ' 9' ' ' LYS . 99.5 t -152.78 75.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.252 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.98 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -51.01 145.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.114 0.483 . . . . 0.0 110.419 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.691 ' HE2' ' CG1' ' B' ' 7' ' ' VAL . 0.5 OUTLIER -142.16 -10.3 0.87 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.156 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.609 ' ND2' ' HZ ' ' B' ' 73' ' ' PHE . 7.1 t-20 -162.54 72.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.564 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.788 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -113.05 90.53 3.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.543 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.685 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 21.5 m-20 -90.92 26.96 1.94 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.1 0.476 . . . . 0.0 110.334 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.741 ' HG3' ' H ' ' B' ' 14' ' ' SER . 13.7 ttp -111.2 170.63 7.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.89 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.851 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 40.8 t -53.84 128.57 30.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.664 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.716 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 20.1 mt-10 -37.63 -68.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.896 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -46.51 -27.7 1.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.827 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.851 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -73.88 -45.77 48.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.976 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 1.024 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -62.18 -30.03 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 19' ' ' GLN . . . . . 0.551 ' HG2' ' HD3' ' B' ' 4' ' ' ARG . 74.5 mt-30 -77.84 -41.59 36.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.052 0.453 . . . . 0.0 109.908 179.504 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.469 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -69.24 -29.26 67.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.712 179.177 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.845 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 13.9 t -68.72 -48.7 63.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.184 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.888 HG22 ' CD2' ' B' ' 76' ' ' PHE . 74.2 t -57.58 -43.8 83.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.404 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.5 -35.35 77.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.806 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 90.9 m -71.35 -35.22 71.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.738 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.765 ' HA ' HG12 ' B' ' 42' ' ' ILE . . . -71.61 -32.25 67.8 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.519 ' HA ' HD12 ' B' ' 29' ' ' LEU . 90.9 m -72.1 -42.23 66.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.372 -1.286 . . . . 0.0 109.663 178.603 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.584 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 2.0 mm-40 -52.72 -46.42 67.38 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.241 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.908 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -64.76 -38.18 90.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.887 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.714 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -64.07 -33.23 75.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.617 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -78.71 -32.09 46.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.764 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 5.8 mmtt -85.54 -19.91 30.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.654 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.537 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -165.98 164.37 18.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.776 179.677 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -124.55 27.99 6.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.756 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.848 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.7 mm -104.5 107.86 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.938 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.781 ' HA ' HD12 ' B' ' 38' ' ' ILE . 0.9 OUTLIER -30.31 -70.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.501 ' H ' ' HG2' ' B' ' 36' ' ' LYS . 1.8 mmmt -44.71 -49.26 10.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.848 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.4 OUTLIER -55.89 -61.02 2.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 179.754 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 1.059 ' HB ' HG11 ' B' ' 58' ' ' VAL . 2.5 mt -46.22 -56.86 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.931 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 0.88 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -44.83 -46.69 10.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.606 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.871 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -65.24 -65.49 0.67 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.436 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.624 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.8 t60 -37.09 -34.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.76 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 1.019 HG21 HD11 ' B' ' 85' ' ' LEU . 39.5 mt -73.46 -66.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.938 179.758 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.877 ' HG2' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -48.5 -24.02 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.503 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.519 ' N ' ' HD3' ' B' ' 43' ' ' LYS . 2.7 tttm -74.89 -58.38 3.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.793 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.785 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 4.1 mt-10 -62.84 -30.67 71.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.68 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.845 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -69.88 -43.29 72.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.836 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.806 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -63.22 -36.99 85.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.129 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -89.94 -24.07 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.714 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.785 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.46 -13.19 35.32 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.402 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.608 ' CE2' ' HE1' ' B' ' 17' ' ' MET . 2.6 m-85 -126.75 -71.59 0.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.461 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 3.7 m-20 162.02 113.8 0.01 OUTLIER Pre-proline 0 N--CA 1.453 -0.309 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.806 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 44.7 Cg_exo -35.63 148.25 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.523 2.149 . . . . 0.0 112.7 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.694 ' O ' ' HB3' ' B' ' 87' ' ' LYS . 2.1 m -123.98 136.73 54.49 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.102 0.561 . . . . 0.0 110.258 -0.145 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.776 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 62.5 m95 -103.03 129.0 49.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.211 0.529 . . . . 0.0 112.254 -178.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.822 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 7.8 m-70 -112.33 115.88 29.46 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.944 ' HB3' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -134.32 170.32 15.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.693 0.758 . . . . 0.0 112.687 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 0.854 HG12 ' H ' ' A' ' 65' ' ' TYR . 43.8 mt -149.54 165.94 3.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.341 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.059 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.4 p -161.06 116.02 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 0.0 111.13 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.725 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.38 -113.04 1.22 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.234 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.814 ' CZ ' ' HB3' ' A' ' 61' ' ' ASN . 0.0 OUTLIER 174.59 -4.6 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 120.579 0.228 . . . . 0.0 111.59 -179.594 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.583 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -170.86 34.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.434 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' B' ' 63' ' ' GLY . 9.5 p90 -99.84 -169.61 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.092 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.673 ' HA3' ' N ' ' A' ' 36' ' ' LYS . . . -147.5 96.69 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.742 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.995 ' CB ' HD12 ' A' ' 57' ' ' ILE . 8.8 p -81.46 149.15 28.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.141 0.496 . . . . 0.0 111.78 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.815 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 15.9 t80 -152.2 69.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.147 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 1.046 HG13 HD11 ' A' ' 57' ' ' ILE . 10.2 m -114.68 150.25 16.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.322 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.892 HG21 ' CG2' ' A' ' 53' ' ' THR . 5.2 t -77.26 119.49 20.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.082 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.557 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -83.72 148.05 27.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.71 179.807 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.755 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.88 -105.44 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.163 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.613 ' CG2' ' HB2' ' B' ' 87' ' ' LYS . 0.2 OUTLIER -37.54 -101.58 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.479 -179.728 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.62 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 2.9 mmtp -80.81 55.91 2.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.789 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.737 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 9.5 m80 30.99 -89.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.894 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.777 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 0.2 OUTLIER 165.18 -179.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.519 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 1.024 HD12 ' HA ' ' B' ' 18' ' ' GLN . 1.1 tt -151.83 115.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.639 ' HE2' ' HG ' ' B' ' 64' ' ' SER . 0.9 OUTLIER -111.39 92.76 4.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.812 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.98 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.2 p90 -111.04 168.85 9.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.647 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 49.1 t80 -130.64 112.98 13.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.618 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 1.051 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -69.16 170.36 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.75 -48.74 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.781 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.514 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 4.2 pt20 -145.95 37.57 1.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.862 0.363 . . . . 0.0 110.987 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.679 HG12 ' N ' ' B' ' 82' ' ' ALA . 69.5 t -154.68 169.08 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.01 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.969 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.6 157.74 40.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.664 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.969 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -145.07 117.12 2.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.979 0.419 . . . . 0.0 111.548 -179.702 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 0.9 HD22 ' HB3' ' B' ' 64' ' ' SER . 0.1 OUTLIER -106.74 92.29 4.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.177 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 1.019 HD11 HG21 ' B' ' 42' ' ' ILE . 0.2 OUTLIER -96.3 143.74 27.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.529 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.763 ' CE1' HG21 ' B' ' 66' ' ' VAL . 2.4 p90 179.17 136.97 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.729 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.776 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -103.74 162.88 12.72 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.647 179.506 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.822 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.4 OUTLIER -119.52 21.02 12.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.797 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.495 -179.954 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' HD13 ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.867 0.365 . . . . 0.0 110.645 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 1.089 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.11 -165.48 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.398 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.574 ' N ' ' O ' ' A' ' 77' ' ' TYR . 79.4 t -155.21 73.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ILE . . . . . 0.947 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.52 158.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.191 0.52 . . . . 0.0 110.77 -179.515 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.761 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 6.9 mmtt -156.87 -11.91 0.09 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.1 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASN . . . . . 0.501 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.1 OUTLIER -169.39 87.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.502 -179.817 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.797 ' HB1' ' OE1' ' A' ' 18' ' ' GLN . . . -123.61 95.77 4.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.836 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.781 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 8.4 m-20 -84.78 36.49 0.61 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.275 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.859 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 14.2 ttp -125.19 164.41 20.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.051 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.613 ' H ' ' HG3' ' A' ' 13' ' ' MET . 52.8 p -55.81 123.89 15.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.859 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 8.8 mt-10 -29.35 -68.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.351 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -44.38 -41.83 6.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' MET . . . . . 0.802 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -65.69 -31.02 71.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.143 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.859 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -71.74 -34.54 69.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.023 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLN . . . . . 0.553 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 0.9 OUTLIER -75.27 -40.45 58.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.198 0.523 . . . . 0.0 110.043 179.603 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.37 -26.27 62.72 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.825 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.843 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 35.1 t -71.34 -43.74 66.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.197 179.302 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 18' ' ' GLN . 40.5 t -61.01 -46.2 97.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.354 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.643 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 64.9 mt-10 -57.68 -43.11 84.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.312 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.564 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 3.3 m -64.21 -36.62 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.199 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.99 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -69.83 -33.47 72.34 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.583 ' HA ' HD12 ' A' ' 29' ' ' LEU . 24.0 m -68.86 -38.09 79.5 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.154 -1.384 . . . . 0.0 109.675 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.777 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 21.7 mm100 -60.34 -40.67 91.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.98 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.936 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -69.28 -33.58 73.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.743 179.047 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.862 HD21 HG11 ' A' ' 81' ' ' VAL . 1.2 mt -67.94 -45.93 72.9 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -26.5 65.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.714 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.777 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 5.9 mttp -88.75 -25.72 22.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.844 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.522 ' HE1' ' CB ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -160.07 140.66 11.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.584 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.523 ' C ' HD13 ' A' ' 34' ' ' ILE . 1.4 t-20 -103.57 30.15 5.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 0.0 110.946 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 1.009 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.9 mm -112.5 104.81 17.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.112 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 1.023 ' HA ' HD12 ' A' ' 38' ' ' ILE . 13.2 mp0 -24.34 -79.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.2 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.657 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.2 OUTLIER -40.19 -48.07 2.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.766 179.737 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 1.009 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -56.8 -54.66 43.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.793 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 1.023 HD12 ' HA ' ' A' ' 35' ' ' GLU . 2.8 mt -50.46 -48.82 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.989 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -55.46 -61.98 1.98 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.846 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.822 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -39.81 -59.67 1.13 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.936 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -49.45 -51.54 34.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.206 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.99 HG12 ' HA ' ' A' ' 25' ' ' ALA . 8.2 mt -54.04 -65.31 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.225 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.74 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 22.6 tttm -46.86 -69.47 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.066 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 44' ' ' LYS . 15.3 mmtt -33.18 -59.0 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.969 -179.774 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.747 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 3.8 tp10 -65.08 -30.67 71.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.706 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' PHE . . . . . 0.843 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -79.1 -7.48 58.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.244 -179.88 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.808 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 7.0 m-20 -101.45 -29.07 12.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.158 0.504 . . . . 0.0 110.04 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.577 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -93.76 -23.38 18.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.867 179.805 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.747 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -89.48 -17.27 28.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.217 -179.676 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.745 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 4.2 m-85 -137.91 -64.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.338 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.745 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 17.2 p-10 157.24 119.05 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.113 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.808 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 39.5 Cg_endo -66.07 170.47 11.71 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 122.56 2.174 . . . . 0.0 112.465 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.752 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 0.3 OUTLIER -104.4 132.39 50.7 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.834 0.453 . . . . 0.0 110.634 -0.147 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' TRP . . . . . 0.773 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 42.7 m95 -99.78 92.46 5.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.298 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' HIS . . . . . 0.78 ' C ' HG12 ' B' ' 66' ' ' VAL . 2.4 m170 -62.12 88.85 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 1.082 ' HB2' HD12 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -103.66 131.08 51.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.306 -178.232 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.977 ' CG1' HD23 ' A' ' 84' ' ' LEU . 19.3 mm -123.7 100.31 7.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.566 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' VAL . . . . . 0.989 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.0 p -98.71 118.43 45.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.883 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -138.72 -128.66 2.6 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.847 -0.692 . . . . 0.0 111.902 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.575 ' HE ' ' HB3' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -165.75 -1.59 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.762 0.315 . . . . 0.0 111.051 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 4.1 t-20 174.72 35.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.924 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.816 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 6.7 p90 -87.08 166.56 14.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.051 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.877 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -116.35 84.32 0.36 Allowed Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.821 ' CB ' HD22 ' A' ' 84' ' ' LEU . 90.0 p -80.84 125.19 29.78 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.105 0.479 . . . . 0.0 111.947 -178.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.81 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 36.5 t80 -131.42 66.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.708 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.851 HG12 ' HB3' ' B' ' 55' ' ' HIS . 3.0 m -99.8 172.67 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.266 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.808 HG21 HG21 ' B' ' 53' ' ' THR . 15.5 m -111.02 72.98 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.703 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' HIS . . . . . 0.509 ' NE2' ' OD2' ' A' ' 12' ' ' ASP . 24.1 p-80 -56.44 -164.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.205 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.462 ' N ' ' CD2' ' A' ' 68' ' ' HIS . 11.4 pt-20 168.37 -153.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.667 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.487 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER 51.88 -99.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.776 ' O ' ' HA ' ' A' ' 13' ' ' MET . 3.0 pttt 173.67 20.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.79 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.859 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 62.7 m-70 -121.78 43.72 2.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.757 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PHE . . . . . 0.781 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 3.7 t80 -116.06 110.7 19.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.499 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.833 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.3 tt -123.65 127.12 73.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.317 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ASN . 58.6 t80 -120.96 110.12 15.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.451 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.947 ' HB3' HG13 ' A' ' 8' ' ' ILE . 2.2 p90 -135.68 173.89 11.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.24 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.716 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 28.4 t80 -127.23 113.95 17.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.052 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.089 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -78.4 -178.3 5.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.684 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 79' ' ' GLY . . . . . 0.623 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -60.42 90.82 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.074 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLN . . . . . 0.716 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 31.6 mt-30 78.19 21.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.865 0.364 . . . . 0.0 110.622 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' VAL . . . . . 0.862 HG11 HD21 ' A' ' 29' ' ' LEU . 90.0 t -151.2 171.54 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.881 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ALA . . . . . 0.782 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -147.95 153.61 39.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.013 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.782 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.3 OUTLIER -136.29 127.29 42.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.134 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.977 HD23 ' CG1' ' A' ' 57' ' ' ILE . 4.1 tp -111.69 86.6 2.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.651 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 1.082 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -93.34 125.99 38.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 -179.67 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.787 ' CE1' HG21 ' A' ' 66' ' ' VAL . 7.5 p90 -166.72 134.74 2.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . 0.752 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.99 -162.16 0.88 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.648 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 88' ' ' SER . . . . . 0.459 ' HA ' ' OE2' ' A' ' 69' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.176 0.512 . . . . 0.0 110.981 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 4' ' ' ARG . . . . . 0.443 ' HA ' ' HD3' ' B' ' 4' ' ' ARG . 6.6 mmt85 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.83 0.348 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 5' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' B' ' 6' ' ' ALA . 0.0 OUTLIER 62.07 -174.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.894 179.798 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 6' ' ' ALA . . . . . 0.997 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 71.77 170.11 0.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.447 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 7' ' ' VAL . . . . . 0.661 HG12 ' HE2' ' B' ' 9' ' ' LYS . 89.6 t -134.65 66.96 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.369 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 8' ' ' ILE . . . . . 0.767 ' HA ' ' O ' ' B' ' 75' ' ' TYR . 0.8 OUTLIER -28.95 140.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.917 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 9' ' ' LYS . . . . . 0.661 ' HE2' HG12 ' B' ' 7' ' ' VAL . 5.7 mmtt -132.13 -0.36 3.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.628 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 10' ' ' ASN . . . . . 0.499 ' HB2' ' O ' ' B' ' 9' ' ' LYS . 2.0 t-20 171.56 87.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.733 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.936 ' HB1' HE21 ' B' ' 18' ' ' GLN . . . -119.4 89.86 3.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.57 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 12' ' ' ASP . . . . . 0.635 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -91.02 30.05 1.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.459 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.672 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -117.7 168.42 10.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.761 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 14' ' ' SER . . . . . 0.831 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 0.4 OUTLIER -43.02 141.63 1.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.977 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 15' ' ' GLU . . . . . 0.75 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -52.49 -58.28 7.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.674 179.718 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 16' ' ' GLU . . . . . 0.753 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -57.79 -26.3 61.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.51 179.624 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 17' ' ' MET . . . . . 0.831 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -74.27 -44.3 53.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 18' ' ' GLN . . . . . 1.034 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -65.46 -37.29 86.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.603 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -75.32 -41.06 57.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.635 179.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 20' ' ' ASP . . . . . 0.753 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.4 OUTLIER -69.81 -27.96 65.32 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.482 178.839 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 21' ' ' SER . . . . . 0.786 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -67.37 -47.35 70.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.091 179.173 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.904 HG22 ' CD2' ' B' ' 76' ' ' PHE . 73.9 t -58.22 -48.65 84.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.438 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -56.1 -39.32 71.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.404 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' CYS . . . . . 0.548 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -65.61 -36.02 82.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.985 0.421 . . . . 0.0 110.045 179.319 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.778 ' C ' HD12 ' B' ' 29' ' ' LEU . . . -68.81 -35.68 77.3 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.585 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 4.1 m -65.45 -44.25 87.81 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.744 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 27' ' ' GLN . . . . . 0.759 ' O ' ' HD2' ' B' ' 31' ' ' LYS . 10.6 mm100 -51.99 -49.32 63.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.686 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 28' ' ' ALA . . . . . 0.827 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -75.42 -16.13 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.605 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.778 HD12 ' C ' ' B' ' 25' ' ' ALA . 5.2 mt -82.12 -33.8 29.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.246 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -85.11 -33.66 22.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.386 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 31' ' ' LYS . . . . . 0.759 ' HD2' ' O ' ' B' ' 27' ' ' GLN . 0.1 OUTLIER -78.68 -29.25 45.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.952 0.406 . . . . 0.0 110.548 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 32' ' ' TYR . . . . . 0.63 ' CD1' ' N ' ' B' ' 32' ' ' TYR . 0.0 OUTLIER -149.39 151.65 34.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.64 179.789 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 33' ' ' ASN . . . . . 0.612 ' C ' HD13 ' B' ' 34' ' ' ILE . 12.2 m-80 -115.29 30.54 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.957 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 34' ' ' ILE . . . . . 0.953 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.1 mm -109.29 106.83 21.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 35' ' ' GLU . . . . . 0.877 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.0 mm-40 -31.6 -70.21 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.9 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 36' ' ' LYS . . . . . 0.509 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 5.2 mtmm -45.91 -61.05 1.9 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.873 0.368 . . . . 0.0 110.594 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 37' ' ' ASP . . . . . 0.953 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.1 m-20 -44.68 -63.6 0.87 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.765 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 38' ' ' ILE . . . . . 0.827 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 4.4 mt -43.63 -57.28 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.141 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 39' ' ' ALA . . . . . 1.05 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.14 -41.55 36.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 40' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -59.96 -64.49 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.059 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 41' ' ' HIS . . . . . 0.577 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -47.34 -39.37 14.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.99 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 42' ' ' ILE . . . . . 0.716 HG21 HD11 ' B' ' 85' ' ' LEU . 81.9 mt -59.1 -60.98 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.973 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 43' ' ' LYS . . . . . 0.822 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.1 OUTLIER -46.34 -55.58 7.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.893 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 44' ' ' LYS . . . . . 0.595 ' O ' ' HB3' ' B' ' 48' ' ' LYS . 0.1 OUTLIER -53.85 -35.79 61.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 -179.893 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 45' ' ' GLU . . . . . 0.739 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 5.2 mm-40 -74.43 -40.32 62.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.368 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 46' ' ' PHE . . . . . 0.786 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.77 -35.03 72.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 110.715 179.99 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 47' ' ' ASP . . . . . 0.807 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.9 m-20 -74.18 -31.47 62.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.0 109.91 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 48' ' ' LYS . . . . . 0.595 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -90.0 -24.17 21.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.663 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 49' ' ' LYS . . . . . 0.739 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.24 -30.41 17.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 50' ' ' TYR . . . . . 0.668 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 28.4 m-85 -123.85 -59.55 1.51 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.599 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 51' ' ' ASN . . . . . 0.503 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER 155.32 118.92 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.097 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.093 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 52' ' ' PRO . . . . . 0.807 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 18.1 Cg_endo -58.15 167.97 4.07 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.44 2.094 . . . . 0.0 112.502 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 53' ' ' THR . . . . . 0.808 HG21 HG21 ' A' ' 67' ' ' THR . 11.3 t -110.71 120.03 41.06 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.749 0.42 . . . . 0.0 110.653 0.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 54' ' ' TRP . . . . . 0.83 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 27.6 m95 -92.7 117.01 29.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.918 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 55' ' ' HIS . . . . . 0.851 ' HB3' HG12 ' A' ' 66' ' ' VAL . 0.3 OUTLIER -85.15 91.33 8.1 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.928 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 56' ' ' CYS . . . . . 0.822 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 5.7 p -101.8 150.5 23.09 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -177.601 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 57' ' ' ILE . . . . . 1.017 HG13 HD23 ' B' ' 84' ' ' LEU . 13.3 mm -130.56 159.34 42.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.883 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 58' ' ' VAL . . . . . 1.05 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.3 p -162.03 108.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.89 0.376 . . . . 0.0 111.046 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 59' ' ' GLY . . . . . 0.818 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -129.21 -133.93 3.7 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.953 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 60' ' ' ARG . . . . . 0.422 ' H ' ' H ' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -165.83 -9.17 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.707 0.289 . . . . 0.0 111.36 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 61' ' ' ASN . . . . . 0.575 ' HB3' ' HE ' ' A' ' 60' ' ' ARG . 0.6 OUTLIER -170.54 34.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.367 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.883 ' HB2' ' HA3' ' A' ' 59' ' ' GLY . 17.5 p90 -103.05 -168.61 1.54 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 0.0 110.682 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 63' ' ' GLY . . . . . 0.853 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -143.33 106.12 0.41 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.041 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.951 ' HB2' HD22 ' B' ' 84' ' ' LEU . 63.1 p -89.81 134.93 33.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.082 0.467 . . . . 0.0 111.47 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 65' ' ' TYR . . . . . 0.822 ' CE2' ' HA ' ' A' ' 40' ' ' ALA . 56.3 t80 -144.96 79.34 1.59 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.997 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.842 HG13 HD11 ' A' ' 57' ' ' ILE . 4.9 m -131.51 166.75 27.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.565 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 67' ' ' THR . . . . . 0.614 HG22 ' NE2' ' A' ' 55' ' ' HIS . 1.6 t -79.32 170.11 17.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.584 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 68' ' ' HIS . . . . . 0.818 ' HB3' ' CD2' ' B' ' 73' ' ' PHE . 2.4 p-80 -129.85 154.9 46.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 69' ' ' GLU . . . . . 0.711 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.0 OUTLIER -143.32 170.41 15.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.815 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 70' ' ' THR . . . . . 0.434 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 44.49 -95.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.122 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 71' ' ' LYS . . . . . 0.623 ' O ' ' HB2' ' B' ' 13' ' ' MET . 7.1 mmtt -92.17 35.05 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.098 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 72' ' ' HIS . . . . . 0.751 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 13.5 m-70 51.08 -85.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.084 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' ' HB3' ' B' ' 68' ' ' HIS . 0.3 OUTLIER 165.52 -166.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.706 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 1.034 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -162.22 124.38 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.99 0.424 . . . . 0.0 111.666 179.529 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 75' ' ' TYR . . . . . 0.97 ' CZ ' HD13 ' B' ' 84' ' ' LEU . 0.5 OUTLIER -113.82 146.38 40.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.92 178.87 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 76' ' ' PHE . . . . . 0.909 ' HE1' HG23 ' B' ' 74' ' ' ILE . 1.4 p90 -170.33 149.15 3.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.849 0.357 . . . . 0.0 111.184 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 77' ' ' TYR . . . . . 0.603 ' O ' ' N ' ' B' ' 7' ' ' VAL . 1.3 t80 -113.99 112.03 22.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.83 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 78' ' ' LEU . . . . . 0.997 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -69.18 169.67 11.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.555 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 79' ' ' GLY . . . . . 0.49 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.53 -42.64 0.02 OUTLIER Glycine 0 CA--C 1.518 0.232 0 C-N-CA 121.088 -0.577 . . . . 0.0 112.89 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 80' ' ' GLN . . . . . 0.49 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.3 OUTLIER -153.55 40.1 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.971 0.415 . . . . 0.0 110.618 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 81' ' ' VAL . . . . . 0.818 HG13 ' O ' ' B' ' 59' ' ' GLY . 77.9 t -156.4 168.46 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.055 -179.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 82' ' ' ALA . . . . . 0.999 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.58 157.48 41.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.578 179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 83' ' ' ILE . . . . . 0.999 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -148.57 132.02 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 0.0 111.831 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 84' ' ' LEU . . . . . 1.017 HD23 HG13 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -125.19 101.32 6.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.257 179.332 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 85' ' ' LEU . . . . . 0.796 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 3.6 mp -101.1 133.73 45.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.12 -179.612 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 86' ' ' PHE . . . . . 0.704 ' CE1' ' HB2' ' B' ' 55' ' ' HIS . 3.2 p90 -172.68 122.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.421 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 87' ' ' LYS . . . . . 0.83 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -104.75 168.34 9.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.658 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 88' ' ' SER . . . . . 0.711 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 4.3 m -122.15 19.45 10.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.319 0.58 . . . . 0.0 110.815 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.437 -1.202 . . . . 0.0 112.546 -179.968 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.809 0.338 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.15 129.73 36.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.974 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.567 ' OD2' ' HB3' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -85.99 -135.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.827 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.488 ' H ' ' HB2' ' A' ' 3' ' ' ASP . 1.1 ttt180 51.71 11.4 0.13 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.755 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 17.6 tptp -74.76 43.09 0.18 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.051 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.05 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -110.23 -172.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.954 0.407 . . . . 0.0 111.263 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.502 ' N ' ' O ' ' A' ' 77' ' ' TYR . 95.6 t -140.04 77.35 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.747 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.804 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -42.85 149.86 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.064 0.459 . . . . 0.0 110.839 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.505 ' HE3' ' HB2' ' A' ' 77' ' ' TYR . 2.4 mmtt -137.71 -13.85 1.46 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.329 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -176.32 112.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.45 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.766 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -131.71 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 0.0 111.682 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.71 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -137.87 25.86 2.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.694 179.326 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.811 ' SD ' ' HE2' ' A' ' 17' ' ' MET . 25.7 ttp -117.08 166.44 12.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.723 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.988 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 74.4 m -51.92 135.93 29.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.715 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.723 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -41.81 -77.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.742 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.635 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.7 OUTLIER -45.95 -19.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.474 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.988 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.16 -42.22 26.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.45 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.861 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -69.27 -28.37 66.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.492 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.692 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 11.8 pt20 -75.78 -45.79 34.26 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.692 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 2.1 m-20 -67.11 -30.82 70.95 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.76 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.852 ' OG ' HD22 ' A' ' 85' ' ' LEU . 29.0 t -65.08 -47.61 76.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.922 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.811 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 56.4 t -57.85 -48.09 84.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.799 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.619 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 52.3 mt-10 -60.74 -38.3 84.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.353 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.625 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 57.1 m -66.41 -34.08 77.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.193 0.521 . . . . 0.0 109.668 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.898 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -70.21 -39.9 74.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.589 ' HA ' HD12 ' A' ' 29' ' ' LEU . 55.2 m -66.09 -38.88 89.35 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.958 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.594 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 7.6 mm-40 -58.19 -41.59 84.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.806 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.882 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -70.97 -29.14 65.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.794 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.898 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.0 OUTLIER -72.05 -41.92 66.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.026 179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.21 -36.55 77.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.184 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.523 ' HD3' ' CE1' ' A' ' 41' ' ' HIS . 2.1 mttp -79.73 -25.72 41.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.738 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.581 ' CE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.43 143.34 18.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -108.61 30.3 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.901 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.929 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 8.0 mm -110.53 111.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.849 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.741 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 8.5 mp0 -28.47 -82.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.823 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.547 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -37.19 -48.62 0.86 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.551 179.519 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.929 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.6 t70 -53.09 -63.53 1.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.804 ' HB ' HG11 ' A' ' 58' ' ' VAL . 5.3 mt -46.32 -47.06 6.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.805 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 1.026 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -56.53 -50.71 71.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.001 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.811 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -57.59 -55.46 34.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.775 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.882 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 1.2 t60 -47.1 -46.92 23.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.564 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.805 HG21 HD11 ' A' ' 85' ' ' LEU . 49.6 mt -61.1 -71.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.793 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 1.1 tmtt? -42.64 -40.56 2.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.151 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.467 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 24.3 tptt -55.57 -62.28 1.79 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.171 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.65 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp0 -62.76 -49.83 73.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.794 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -55.18 -35.67 65.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.26 -179.687 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.793 ' HB2' ' HE2' ' A' ' 43' ' ' LYS . 0.8 OUTLIER -72.02 -38.06 69.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.108 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.08 9.23 43.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.106 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.65 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -128.92 5.17 5.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.164 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.779 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 63.9 m-85 -144.61 -66.75 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.035 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.779 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 5.6 p30 162.57 109.18 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.187 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.7 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 77.0 Cg_exo -47.77 149.44 5.18 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 122.432 2.088 . . . . 0.0 112.477 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.799 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 11.0 t -119.51 135.82 54.61 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.056 0.542 . . . . 0.0 110.657 -0.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.716 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 47.4 m95 -96.67 124.61 40.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 111.741 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.791 ' CE1' HG23 ' A' ' 53' ' ' THR . 0.0 OUTLIER -107.94 101.98 11.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.726 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.999 ' HB2' HD12 ' A' ' 85' ' ' LEU . 1.9 p -116.86 152.17 35.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.265 0.555 . . . . 0.0 112.425 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.055 HG21 HG21 ' B' ' 57' ' ' ILE . 20.8 mm -130.36 110.96 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.379 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.026 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.4 p -105.18 121.23 56.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.38 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.696 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -162.42 176.35 38.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.144 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.694 ' HB3' ' HA ' ' A' ' 81' ' ' VAL . 0.1 OUTLIER -138.07 40.97 2.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.651 0.262 . . . . 0.0 111.297 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.712 ' O ' ' HG2' ' B' ' 60' ' ' ARG . 2.5 t-20 168.61 25.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.885 0.374 . . . . 0.0 111.208 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.932 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 15.1 p90 -109.34 -166.95 1.15 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.609 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.851 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -150.71 102.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.047 -0.597 . . . . 0.0 111.97 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.956 ' CB ' HD12 ' B' ' 57' ' ' ILE . 88.4 p -86.11 134.57 33.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.096 0.474 . . . . 0.0 111.584 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.829 ' HB3' ' HB1' ' B' ' 39' ' ' ALA . 60.1 t80 -149.83 87.49 1.49 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.057 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.871 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 11.5 m -132.66 168.1 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.216 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.928 HG21 ' CG2' ' B' ' 53' ' ' THR . 13.2 t -92.14 83.23 5.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.571 ' C ' ' HG2' ' A' ' 69' ' ' GLU . 32.2 p-80 -55.68 -179.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.49 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HG2' ' C ' ' A' ' 68' ' ' HIS . 0.7 OUTLIER 176.38 -166.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.918 0.39 . . . . 0.0 111.228 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.49 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 58.86 -100.23 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.836 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.49 ' H ' ' HB ' ' A' ' 70' ' ' THR . 1.3 mtmp? 179.15 28.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.991 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.79 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 3.7 m-70 -138.27 54.12 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.348 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.828 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.1 t80 -125.04 89.93 3.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.186 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.861 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.2 tt -109.55 142.44 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 111.673 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.63 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 21.6 t80 -130.96 131.55 44.49 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.063 179.034 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.811 ' CE2' ' HA ' ' A' ' 22' ' ' VAL . 1.2 p90 -154.85 179.27 9.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.152 -179.408 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.751 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 24.4 t80 -137.91 104.15 5.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.698 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.05 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.3 mm? -58.86 173.74 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.083 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.456 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.15 -44.59 0.17 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.039 -0.6 . . . . 0.0 112.872 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.661 ' O ' ' HG3' ' A' ' 80' ' ' GLN . 66.0 tp60 -144.8 25.58 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.609 0.242 . . . . 0.0 111.323 -179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.829 HG12 ' H ' ' A' ' 82' ' ' ALA . 13.9 t -146.79 178.04 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.841 0.353 . . . . 0.0 111.111 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.847 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -141.11 154.07 45.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.842 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.847 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -139.26 137.26 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.154 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.001 HD23 HG12 ' A' ' 57' ' ' ILE . 3.0 tp -121.89 81.81 1.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.573 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.999 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -85.87 126.66 34.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.329 -179.616 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.828 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -168.7 125.0 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.497 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.799 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -98.59 -171.27 2.09 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.631 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.457 ' OG ' ' HB3' ' B' ' 88' ' ' SER . 0.5 OUTLIER -125.97 20.17 7.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.238 0.542 . . . . 0.0 110.641 179.919 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.456 ' HA3' HG21 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.251 1.166 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.47 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.819 0.342 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -147.83 63.4 1.12 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.036 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 34.5 t0 53.93 -113.27 0.77 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.695 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.668 ' HD2' ' HA ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER 53.03 72.07 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.129 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.59 ' C ' HD13 ' B' ' 78' ' ' LEU . 5.9 tppt? -93.51 47.21 1.23 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.091 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.019 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.32 -175.5 3.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.301 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' B' ' 77' ' ' TYR . 69.3 t -141.2 74.03 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.774 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.973 HD11 HD11 ' B' ' 74' ' ' ILE . 1.1 mp -34.1 157.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.074 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.752 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 6.1 mmpt? -146.4 -15.08 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.936 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.441 ' O ' ' N ' ' B' ' 75' ' ' TYR . 2.2 m-20 179.81 102.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.486 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.749 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -130.52 104.54 7.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.899 0.381 . . . . 0.0 111.935 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.604 ' N ' ' O ' ' B' ' 73' ' ' PHE . 4.4 t70 -89.21 30.6 0.95 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.154 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.914 ' SD ' ' HE2' ' B' ' 17' ' ' MET . 28.4 ttp -120.96 156.06 32.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.909 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.76 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.8 OUTLIER -46.98 135.78 9.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.59 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.762 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 10.6 mm-40 -41.36 -69.7 0.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.226 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 18.0 mm-40 -44.99 -37.97 4.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.891 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.914 ' HE2' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -65.64 -33.23 75.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.61 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.886 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.37 -29.48 63.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.103 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.668 ' HA ' ' HD2' ' B' ' 4' ' ' ARG . 6.7 pt20 -75.9 -41.74 51.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 0.0 110.382 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.41 -28.83 62.21 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.887 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.917 ' OG ' HD22 ' B' ' 85' ' ' LEU . 1.8 t -67.6 -44.27 78.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.184 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.882 HG23 ' O ' ' B' ' 18' ' ' GLN . 47.2 t -63.26 -48.51 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.766 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 85.8 mt-10 -55.06 -41.5 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.562 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 75.5 m -64.39 -37.76 88.64 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.368 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.769 ' HB1' HD12 ' B' ' 83' ' ' ILE . . . -67.9 -28.22 67.32 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.645 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 3.0 m -71.67 -43.22 66.4 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.77 178.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 6.7 mt-30 -53.13 -46.62 68.86 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.619 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.717 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -77.22 -20.26 55.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.291 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 1.072 HD21 HG11 ' B' ' 81' ' ' VAL . 6.3 mt -77.19 -32.96 56.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.11 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -89.42 -27.45 20.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.371 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.752 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 41.9 mmtm -83.47 -29.32 28.11 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.917 0.389 . . . . 0.0 110.705 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.752 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -152.68 141.09 20.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.566 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.71 29.39 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.955 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 1.031 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 7.5 mm -103.61 101.28 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.868 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.851 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.9 mp0 -29.83 -68.85 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.629 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -49.48 -56.2 10.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.818 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 1.031 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -49.27 -63.67 1.04 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.679 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.748 ' O ' HG13 ' B' ' 42' ' ' ILE . 38.8 mt -42.38 -46.31 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.935 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.949 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -63.65 -40.64 97.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.925 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.709 ' HA ' ' CE1' ' A' ' 65' ' ' TYR . . . -57.67 -67.15 0.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.967 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.689 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -46.66 -57.31 4.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.728 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.748 HG13 ' O ' ' B' ' 38' ' ' ILE . 78.1 mt -43.59 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.651 ' HB3' ' CE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -36.99 -48.09 0.75 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.325 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.462 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -59.38 -45.3 91.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.549 -179.601 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.683 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.7 OUTLIER -69.68 -46.9 65.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.359 -179.519 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.825 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -60.85 -33.0 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.979 -179.823 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.781 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.73 -50.2 26.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.721 179.789 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.937 ' HE3' ' HA ' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -72.28 -22.36 61.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.683 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -90.45 -26.57 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.703 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 15.2 m-85 -120.02 -65.35 1.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.192 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.703 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 21.7 t-20 160.27 110.19 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.96 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.781 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 81.2 Cg_exo -43.84 149.79 0.68 Allowed 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 122.49 2.127 . . . . 0.0 112.717 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.928 ' CG2' HG21 ' A' ' 67' ' ' THR . 0.2 OUTLIER -125.75 137.92 53.83 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 122.955 0.502 . . . . 0.0 110.549 -0.104 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.772 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 34.2 m95 -95.28 121.5 37.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.828 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.871 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -91.09 97.91 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.437 178.672 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 1.021 ' HB3' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -113.72 143.44 44.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 112.448 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 1.055 HG21 HG21 ' A' ' 57' ' ' ILE . 21.2 mm -130.11 97.21 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.06 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 0.949 HG12 ' HB2' ' B' ' 39' ' ' ALA . 3.3 p -98.48 129.69 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.971 0.415 . . . . 0.0 111.385 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.733 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.96 -144.03 4.09 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.712 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.63 10.71 0.06 Allowed 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.756 0.312 . . . . 0.0 111.111 -179.659 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.519 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 62.2 t30 175.98 30.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.933 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.932 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 9.5 p90 -102.13 -166.64 1.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.985 0.422 . . . . 0.0 110.976 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.741 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -147.82 86.76 0.16 Allowed Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.919 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.975 ' CB ' HD12 ' A' ' 57' ' ' ILE . 8.3 p -73.28 141.64 47.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.398 . . . . 0.0 111.533 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.837 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 12.1 t80 -147.08 62.34 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.359 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.981 HG13 HD11 ' A' ' 57' ' ' ILE . 21.5 m -102.38 161.31 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' B' ' 69' ' ' GLU . 18.4 m -99.13 94.5 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.846 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.728 ' HA ' ' HD2' ' B' ' 86' ' ' PHE . 0.0 OUTLIER -31.22 -44.48 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.163 -179.853 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' B' ' 68' ' ' HIS . 19.3 pt-20 43.64 36.83 1.33 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.997 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.642 HG22 ' H ' ' B' ' 71' ' ' LYS . 3.0 m -170.16 -136.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.969 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.654 ' O ' ' HA ' ' B' ' 13' ' ' MET . 10.2 mtmm -146.43 12.47 1.19 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.71 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.852 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 8.4 m-70 -119.41 47.59 1.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.678 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.779 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 6.8 t80 -116.47 116.78 28.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.53 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.973 HD11 HD11 ' B' ' 8' ' ' ILE . 0.8 OUTLIER -135.85 125.76 41.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.999 0.428 . . . . 0.0 111.729 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.752 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 16.6 t80 -112.07 136.64 51.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.803 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.949 ' HE1' HG23 ' B' ' 74' ' ' ILE . 2.3 p90 -162.56 164.1 26.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 111.246 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.518 ' O ' ' N ' ' B' ' 7' ' ' VAL . 65.4 t80 -122.52 109.62 14.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.015 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.019 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -70.27 170.37 11.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.629 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.13 -47.03 0.02 OUTLIER Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.191 -0.528 . . . . 0.0 112.932 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.458 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 18.4 mt-30 -149.56 37.18 0.74 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.905 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 1.072 HG11 HD21 ' B' ' 29' ' ' LEU . 85.6 t -154.02 170.84 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.162 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.726 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -137.43 141.72 41.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.866 HD11 HD11 ' B' ' 29' ' ' LEU . 0.2 OUTLIER -128.24 128.6 68.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.07 0.462 . . . . 0.0 111.678 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.899 HD23 ' CG1' ' B' ' 57' ' ' ILE . 1.2 tp -116.31 85.3 2.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.031 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 1.021 HD12 ' HB3' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -93.03 128.94 39.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.573 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.728 ' HD2' ' HA ' ' B' ' 68' ' ' HIS . 1.2 p90 -167.62 123.7 1.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.849 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.772 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 32.7 mtpt -91.59 159.88 15.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.753 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.662 ' H ' ' CE1' ' B' ' 55' ' ' HIS . 32.2 m -105.17 18.31 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.302 0.572 . . . . 0.0 110.799 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.428 -1.207 . . . . 0.0 112.544 -179.962 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 mtp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.837 0.351 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.41 ' C ' ' CG ' ' A' ' 3' ' ' ASP . 0.4 OUTLIER -133.49 -50.32 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.864 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.41 ' CG ' ' C ' ' A' ' 2' ' ' CYS . 0.0 OUTLIER 175.36 136.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.96 179.954 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.99 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.5 OUTLIER 54.62 24.48 5.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.708 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.638 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 20.7 tptm -79.75 67.19 5.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.177 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.086 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -135.9 -168.95 2.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.79 ' O ' ' HD2' ' A' ' 9' ' ' LYS . 73.6 t -145.67 72.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.932 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 1.065 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -43.92 162.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.251 0.548 . . . . 0.0 111.09 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.79 ' HD2' ' O ' ' A' ' 7' ' ' VAL . 0.0 OUTLIER -149.82 -22.42 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.343 179.095 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.663 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 54.8 t30 -156.5 165.52 36.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.265 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.666 ' HA ' ' CD1' ' A' ' 73' ' ' PHE . . . 166.54 127.97 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.985 0.422 . . . . 0.0 111.911 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.781 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 2.1 m-20 -118.36 26.93 9.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.872 178.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.899 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 28.6 ttp -108.91 167.04 10.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.823 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.69 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.1 OUTLIER -58.14 129.4 41.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.79 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.701 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 mt-10 -33.74 -66.72 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -50.55 -32.92 19.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.785 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.704 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 39.5 mmm -72.63 -33.72 66.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.17 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.895 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.49 -39.41 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.636 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.99 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 1.8 mt-30 -74.48 -34.3 63.08 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.289 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.24 -31.79 66.13 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.848 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.751 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -67.34 -46.45 73.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.18 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.934 HG13 ' CE2' ' A' ' 76' ' ' PHE . 11.8 t -59.67 -45.16 94.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.541 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 43.0 mt-10 -59.64 -37.0 77.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.117 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.646 ' SG ' HG23 ' A' ' 42' ' ' ILE . 11.5 t -66.32 -40.22 89.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.159 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.74 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -67.49 -22.59 65.45 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.688 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 2.3 m -78.85 -46.39 18.72 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.581 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.57 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 7.4 mm100 -48.06 -45.23 32.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.417 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.748 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -77.47 -33.84 54.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.127 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.698 ' CD1' ' HG ' ' A' ' 78' ' ' LEU . 5.5 mt -63.75 -24.02 67.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.055 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -99.43 -28.65 13.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.554 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.805 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 29.5 mmtp -84.87 -27.27 26.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 111.091 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.805 ' CE1' ' HB2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -146.25 161.31 40.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -126.31 36.38 4.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.952 HG22 ' HD3' ' A' ' 36' ' ' LYS . 3.3 mm -120.15 97.43 5.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.829 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.673 ' C ' ' HA3' ' B' ' 63' ' ' GLY . 2.5 mp0 -22.5 -72.71 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.206 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.952 ' HD3' HG22 ' A' ' 34' ' ' ILE . 0.0 OUTLIER -47.62 -51.04 22.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.5 179.617 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.893 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.6 t0 -54.38 -62.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.52 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.754 ' O ' HG13 ' A' ' 42' ' ' ILE . 5.6 mt -43.51 -42.82 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.874 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 1.061 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -65.6 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.902 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.821 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -39.1 -51.39 1.88 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.938 0.399 . . . . 0.0 110.724 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.548 ' CE1' ' CD1' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -64.91 -54.91 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.89 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.762 ' CG2' HD11 ' A' ' 85' ' ' LEU . 83.9 mt -45.72 -56.42 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.098 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.502 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -59.47 -70.9 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.966 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.546 ' C ' ' HD2' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -34.1 -59.97 0.41 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.959 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -46.76 84.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.941 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.751 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -59.76 -18.58 44.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.817 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.715 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -87.84 -34.27 18.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.636 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -99.56 6.72 45.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.755 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.97 6.68 8.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.102 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.56 ' CD1' ' HE1' ' A' ' 17' ' ' MET . 95.2 m-85 -149.1 -67.3 0.22 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.738 ' O ' ' HE2' ' A' ' 87' ' ' LYS . 12.3 m-20 160.93 108.52 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.432 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.715 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 92.0 Cg_exo -43.85 155.76 0.19 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.47 2.113 . . . . 0.0 112.437 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.816 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.5 m -117.2 132.61 56.6 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 123.199 0.6 . . . . 0.0 110.485 -0.048 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.841 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 60.6 m95 -98.81 166.89 11.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.415 0.626 . . . . 0.0 111.951 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.88 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.0 OUTLIER -158.03 109.26 2.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.237 179.269 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.807 ' CB ' HD12 ' A' ' 85' ' ' LEU . 6.2 p -121.96 152.05 40.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.223 0.535 . . . . 0.0 112.425 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.013 HD11 HG13 ' B' ' 66' ' ' VAL . 20.9 mm -129.13 105.93 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.391 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.061 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.6 p -104.13 124.33 58.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.915 0.388 . . . . 0.0 111.675 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.879 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -149.65 -131.45 1.94 Allowed Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.758 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.628 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -160.02 5.64 0.09 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.657 0.265 . . . . 0.0 111.475 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.628 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 41.8 t30 166.7 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.763 0.315 . . . . 0.0 111.312 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.748 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 45.9 p90 -77.5 -178.33 5.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.0 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.62 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.94 76.94 0.39 Allowed Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.177 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.945 ' HA ' HG23 ' B' ' 57' ' ' ILE . 88.6 p -69.98 151.97 44.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.881 0.372 . . . . 0.0 111.354 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.801 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 11.6 t80 -164.22 56.81 0.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.589 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.756 HG11 ' CZ ' ' A' ' 86' ' ' PHE . 6.9 m -80.83 -161.12 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.049 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.781 HG21 ' OG1' ' B' ' 53' ' ' THR . 1.2 m -157.03 96.47 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.221 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.707 ' CD2' ' HA ' ' A' ' 88' ' ' SER . 36.4 t-80 -175.68 -97.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.846 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.636 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 0.6 OUTLIER 43.75 75.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.973 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -101.99 -37.27 8.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.984 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.781 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 4.3 ptpt -177.67 12.18 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.941 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.932 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 61.6 m-70 -136.97 23.99 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.822 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.849 ' HD2' ' HB3' ' A' ' 86' ' ' PHE . 14.1 t80 -105.63 168.8 8.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.852 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.895 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.4 tt 171.54 119.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.124 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.426 ' O ' ' HD3' ' A' ' 9' ' ' LYS . 3.5 t80 -116.52 111.33 19.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.809 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 1.065 ' HB3' HG13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -130.98 176.46 8.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.221 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.732 ' CB ' ' HE2' ' A' ' 9' ' ' LYS . 20.2 t80 -135.93 103.97 5.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.756 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.086 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -61.41 177.66 0.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.916 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.83 -42.03 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.46 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.528 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 2.2 pm0 -154.53 43.04 0.5 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.862 0.363 . . . . 0.0 110.829 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.879 HG13 ' O ' ' A' ' 59' ' ' GLY . 55.6 t -154.49 166.85 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.116 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.63 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -134.68 114.48 12.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.673 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.719 HG21 ' HB2' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -105.71 120.4 56.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.998 0.428 . . . . 0.0 111.429 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.0 HD23 HG12 ' A' ' 57' ' ' ILE . 0.3 OUTLIER -105.06 91.78 3.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.316 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.807 HD12 ' CB ' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -95.86 127.11 41.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -179.282 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.849 ' HB3' ' HD2' ' A' ' 73' ' ' PHE . 30.0 p90 -158.06 144.48 17.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.742 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.932 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -105.14 -170.23 1.72 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.957 0.408 . . . . 0.0 110.771 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.88 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -145.16 17.43 1.56 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.471 0.653 . . . . 0.0 109.994 179.533 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.636 ' H ' ' HZ2' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.351 -1.249 . . . . 0.0 112.521 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.524 ' C ' ' H ' ' B' ' 3' ' ' ASP . 5.3 ttt . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.838 0.351 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.517 ' O ' ' HD3' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -67.02 9.92 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.763 179.931 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.524 ' H ' ' C ' ' B' ' 1' ' ' MET . 6.4 t70 61.93 7.72 2.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.817 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.772 ' HG2' ' CD ' ' B' ' 19' ' ' GLN . 0.1 OUTLIER -116.52 66.01 0.71 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.815 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.676 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.0 OUTLIER -80.44 118.67 22.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.039 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 162.1 -167.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.116 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.675 ' O ' ' HG2' ' B' ' 9' ' ' LYS . 22.7 t -156.67 73.24 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.954 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -47.24 148.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.06 0.457 . . . . 0.0 110.535 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.755 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 2.8 mmtt -154.68 -1.95 0.17 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.324 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.906 ' HB3' ' HB3' ' B' ' 75' ' ' TYR . 20.2 t-20 -164.08 70.3 0.2 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.963 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.764 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -110.73 153.81 24.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.133 0.492 . . . . 0.0 111.511 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.528 ' N ' ' O ' ' B' ' 73' ' ' PHE . 6.9 t70 -149.85 28.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.015 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.925 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 11.9 ttp -121.48 170.82 9.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.66 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.723 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.3 OUTLIER -57.19 140.86 48.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.716 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.713 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 31.5 mp0 -46.0 -63.39 0.99 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.172 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -28.69 19.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.004 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.925 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 53.4 mmm -79.63 -35.56 39.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.048 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.738 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -71.17 -35.67 71.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.921 0.391 . . . . 0.0 110.315 179.657 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.772 ' CD ' ' HG2' ' B' ' 4' ' ' ARG . 12.7 mm100 -75.16 -36.56 61.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.182 0.515 . . . . 0.0 109.646 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.552 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 5.4 m-20 -70.35 -29.28 65.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.653 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.844 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -68.92 -49.22 59.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.905 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.819 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 77.6 t -54.28 -45.29 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.139 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 83.6 mt-10 -58.94 -39.6 82.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.878 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' B' ' 42' ' ' ILE . 13.3 t -65.22 -36.23 83.52 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.009 -0.542 . . . . 0.0 109.968 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.776 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -69.26 -29.56 67.49 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.536 ' HA ' HD12 ' B' ' 29' ' ' LEU . 2.0 m -71.45 -37.69 71.36 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.825 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' B' ' 31' ' ' LYS . 43.1 mt-30 -60.72 -42.73 97.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.692 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.939 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -73.42 -27.2 61.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.583 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.776 HD12 ' O ' ' B' ' 25' ' ' ALA . 2.5 mt -72.98 -49.19 30.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.87 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.75 -26.64 63.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.024 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.646 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 2.6 mttp -86.73 -30.32 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.966 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.63 ' HE1' ' ND1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.6 163.91 36.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.005 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -126.42 27.75 6.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.75 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.695 ' HB ' ' CB ' ' B' ' 37' ' ' ASP . 9.2 mm -108.78 106.39 20.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.797 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.629 ' OE2' ' HA2' ' B' ' 59' ' ' GLY . 2.0 mm-40 -29.78 -71.03 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.452 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -46.82 -48.05 20.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.869 0.366 . . . . 0.0 110.609 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.695 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 14.3 t0 -54.77 -60.81 2.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.648 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.939 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 3.9 mt -48.13 -49.1 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.516 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 1.067 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -56.6 -35.5 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.43 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.801 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -72.04 -63.64 1.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.317 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.741 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -37.47 -56.13 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.14 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.787 HD11 HG22 ' B' ' 38' ' ' ILE . 6.9 mt -56.56 -68.24 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.284 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.644 ' HE3' ' HE2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -38.94 -47.84 1.5 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.827 0.346 . . . . 0.0 111.146 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' B' ' 43' ' ' LYS . 0.4 OUTLIER -61.91 -53.11 60.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.462 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.535 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 1.2 tp10 -60.83 -34.21 74.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.164 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.844 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -67.06 -49.04 66.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.821 0.343 . . . . 0.0 110.606 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.674 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -55.73 -37.66 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.86 -20.2 22.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.383 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 3.0 tttt -88.5 -13.35 40.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 111.18 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.651 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 23.3 m-85 -142.49 -67.54 0.37 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.418 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.651 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 30.8 t-20 160.22 117.32 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.827 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.674 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 10.7 Cg_endo -53.28 168.96 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.442 2.095 . . . . 0.0 112.511 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.781 ' OG1' HG21 ' A' ' 67' ' ' THR . 8.6 t -109.99 122.45 47.61 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 122.833 0.453 . . . . 0.0 110.775 0.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.853 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 48.5 m95 -92.44 120.8 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.704 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.734 ' NE2' HG23 ' B' ' 53' ' ' THR . 0.2 OUTLIER -100.0 105.44 17.11 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.116 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.992 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -130.8 165.28 23.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.52 0.676 . . . . 0.0 112.183 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.988 HD12 HG13 ' A' ' 57' ' ' ILE . 34.3 mt -146.44 165.41 8.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.589 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.067 HG12 ' HB2' ' B' ' 39' ' ' ALA . 1.7 p -155.14 122.35 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 111.596 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.629 ' HA2' ' OE2' ' B' ' 35' ' ' GLU . . . -149.2 -175.02 21.23 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.037 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.646 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.9 OUTLIER -146.3 36.18 1.0 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.218 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.646 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.2 OUTLIER 168.11 26.6 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.121 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.8 ' CE2' ' HB3' ' B' ' 64' ' ' SER . 0.1 OUTLIER -111.48 -166.57 1.09 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.674 ' HA3' ' N ' ' A' ' 36' ' ' LYS . . . -144.8 77.79 0.27 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.843 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 64' ' ' SER . . . . . 1.006 ' HB2' HD12 ' A' ' 57' ' ' ILE . 18.1 p -70.6 131.77 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.034 0.445 . . . . 0.0 111.531 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.821 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 55.7 t80 -144.76 76.51 1.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.304 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 1.013 HG13 HD11 ' A' ' 57' ' ' ILE . 28.5 m -110.2 167.39 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.235 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.594 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 28.7 m -112.8 134.98 54.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.875 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.541 ' HB3' ' CG ' ' B' ' 73' ' ' PHE . 0.7 OUTLIER -87.36 176.63 7.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.834 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.631 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -162.61 56.81 0.22 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.827 -179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.697 HG23 ' H ' ' B' ' 71' ' ' LYS . 2.0 t 169.37 -108.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.947 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.697 ' H ' HG23 ' B' ' 70' ' ' THR . 0.0 OUTLIER -163.26 28.94 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.606 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.965 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 7.3 m80 -128.75 41.96 3.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.983 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 12.9 t80 -117.59 83.65 2.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.357 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.877 HD11 HD11 ' B' ' 8' ' ' ILE . 0.0 OUTLIER -110.94 109.5 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.922 -179.155 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.906 ' HB3' ' HB3' ' B' ' 10' ' ' ASN . 14.1 t80 -99.33 126.02 45.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.315 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.954 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.7 p90 -142.92 170.24 16.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.007 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.659 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 50.9 t80 -132.9 116.94 17.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.621 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.039 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -69.13 167.64 15.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.679 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -29.12 -46.9 0.08 OUTLIER Glycine 0 C--N 1.329 0.145 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.945 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -143.32 27.63 1.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.684 HG12 ' N ' ' B' ' 82' ' ' ALA . 38.3 t -145.41 171.03 5.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.894 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.844 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -132.34 145.52 51.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.882 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.844 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -142.97 106.42 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.153 -179.741 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.787 HD23 ' HB ' ' B' ' 57' ' ' ILE . 0.2 OUTLIER -97.97 110.17 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.575 179.741 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.992 HD12 ' HB2' ' B' ' 56' ' ' CYS . 2.0 mp -106.88 125.21 50.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.9 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.723 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.7 OUTLIER -151.58 119.07 6.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.364 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.965 ' HB2' ' HB2' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -97.01 164.27 12.59 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.758 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.631 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -119.23 18.98 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.341 0.591 . . . . 0.0 110.649 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 89' ' ' GLY . . . . . 0.482 ' HA2' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.339 -1.256 . . . . 0.0 112.467 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.427 ' O ' ' CG ' ' A' ' 1' ' ' MET . 1.4 ttp . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.879 0.371 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 m -102.82 42.33 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.954 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.9 165.83 12.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.941 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.51 ' HD2' ' HB2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -112.74 78.69 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.022 -179.842 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.787 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -64.58 110.21 2.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.75 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.049 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 159.15 172.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.693 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.777 ' O ' ' HE2' ' A' ' 9' ' ' LYS . 8.7 t -131.03 69.37 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.924 HD11 HD11 ' A' ' 74' ' ' ILE . 0.9 OUTLIER -33.48 149.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.777 ' HE2' ' O ' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -134.84 -12.71 2.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.8 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 177.51 93.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.638 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.78 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -129.72 104.13 7.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.723 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.54 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 16.8 m-20 -96.01 27.71 3.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.234 0.54 . . . . 0.0 109.866 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.919 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.9 OUTLIER -103.79 168.96 8.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.783 -179.622 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.902 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -51.32 123.59 9.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.466 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -34.86 -69.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.824 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.525 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 32.6 tt0 -52.15 -28.38 17.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.919 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -71.85 -41.6 67.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.856 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.738 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.42 -29.51 69.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.944 0.402 . . . . 0.0 110.331 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.759 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -77.21 -42.32 37.87 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.097 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.759 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -69.29 -28.4 66.25 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.555 178.986 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.887 ' OG ' HD22 ' A' ' 85' ' ' LEU . 30.0 t -67.11 -51.12 58.07 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.969 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.777 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 94.1 t -54.41 -46.59 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.926 179.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -54.34 -43.62 71.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.351 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -39.27 91.76 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.951 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.731 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -69.39 -30.97 69.07 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -70.68 -37.08 73.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.58 178.499 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.8 mt-30 -58.81 -42.4 89.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.928 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -79.84 -23.03 42.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.289 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.731 HD12 ' O ' ' A' ' 25' ' ' ALA . 4.6 mt -81.1 -26.13 36.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.022 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.23 -32.47 15.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.201 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -86.08 -24.94 26.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.783 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.628 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -150.11 155.86 40.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.614 179.893 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.413 ' HA ' HD11 ' A' ' 38' ' ' ILE . 0.0 OUTLIER -123.54 28.53 6.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.063 0.458 . . . . 0.0 110.735 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.88 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 16.1 mm -106.59 107.54 22.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.942 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.774 ' HB3' ' CA ' ' B' ' 63' ' ' GLY . 0.9 OUTLIER -26.67 -84.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.033 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.01 -47.31 2.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.323 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.88 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -54.75 -63.11 1.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 0.0 111.14 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.928 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 3.2 mt -48.2 -48.21 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.937 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.86 -42.1 92.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.05 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.797 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.4 -64.67 0.77 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.077 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.685 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -52.29 -39.53 60.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.659 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.778 ' CG2' HD11 ' A' ' 85' ' ' LEU . 85.4 mt -58.56 -57.22 11.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.958 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.525 ' HZ2' ' HE2' ' B' ' 65' ' ' TYR . 0.2 OUTLIER -51.57 -60.51 3.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -42.57 -62.23 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.602 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.3 mt-10 -42.98 -67.48 0.27 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.946 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.813 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -44.57 -51.32 9.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.723 ' OD1' ' HB2' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -57.54 -25.02 59.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.087 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -120.97 14.27 11.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.18 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.5 tttp -128.44 1.89 5.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.389 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 72.2 m-85 -152.85 -62.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.185 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.482 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 3.1 m-20 161.24 117.67 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.566 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.583 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 19.1 Cg_endo -60.06 169.18 5.07 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.521 2.147 . . . . 0.0 112.327 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.784 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 88.6 m -104.92 130.58 53.06 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.011 0.525 . . . . 0.0 110.254 -0.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.723 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 69.1 m95 -101.51 170.56 8.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.654 0.74 . . . . 0.0 112.421 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.624 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.3 OUTLIER -162.92 103.64 1.01 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.442 179.495 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.965 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -117.97 156.12 29.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.538 0.685 . . . . 0.0 112.796 -177.667 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.951 ' CG1' HD23 ' A' ' 84' ' ' LEU . 27.0 mm -127.45 157.52 39.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.144 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.937 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.1 p -152.36 112.12 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.888 0.375 . . . . 0.0 111.276 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.502 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -150.75 -155.86 7.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.157 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.49 HH11 ' HB2' ' A' ' 60' ' ' ARG . 0.1 OUTLIER -163.5 34.72 0.09 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 120.76 0.314 . . . . 0.0 111.289 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 2.6 t-20 171.05 26.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.787 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 24.0 p90 -111.12 179.95 3.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.802 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.873 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -135.4 96.29 0.27 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.321 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.905 ' CA ' HD12 ' B' ' 57' ' ' ILE . 4.7 p -82.03 129.82 34.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.061 0.458 . . . . 0.0 111.54 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.803 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 67.3 t80 -143.49 84.18 1.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.118 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.882 HG13 HD11 ' B' ' 57' ' ' ILE . 4.4 m -135.81 159.85 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.306 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.821 HG22 ' CE1' ' B' ' 55' ' ' HIS . 1.3 t -66.75 -171.98 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.034 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.814 ' CD2' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -129.05 172.69 11.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.011 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.738 ' CG ' ' HA ' ' A' ' 88' ' ' SER . 7.1 mm-40 -163.85 143.85 8.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.885 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.707 HG21 ' NZ ' ' A' ' 87' ' ' LYS . 48.3 m 47.64 -102.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.797 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 19.6 mmtt -74.06 32.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.742 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.752 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 53.7 m-70 48.77 -87.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.752 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 2.3 p90 163.51 156.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.786 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.924 HD11 HD11 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -127.96 106.21 14.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 111.024 179.566 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.743 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 63.4 t80 -106.72 93.82 4.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.856 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -107.69 168.59 9.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.331 -179.534 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.897 ' HD1' ' HB2' ' A' ' 82' ' ' ALA . 76.7 t80 -127.0 87.39 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.716 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.049 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -40.67 167.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.465 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.38 -48.58 0.33 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.759 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.25 20.6 2.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.743 HG12 ' N ' ' A' ' 82' ' ' ALA . 39.9 t -140.7 175.12 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.897 ' HB2' ' HD1' ' A' ' 77' ' ' TYR . . . -137.14 143.45 42.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.661 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.666 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 0.2 OUTLIER -132.45 111.49 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 -179.721 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.951 HD23 ' CG1' ' A' ' 57' ' ' ILE . 3.9 tp -94.93 88.81 5.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.417 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.965 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -93.65 141.0 28.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.458 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.699 ' HB3' ' HB2' ' A' ' 73' ' ' PHE . 2.8 p90 -176.51 152.23 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.797 ' HZ3' ' HG2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -112.43 -168.46 1.32 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.841 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.738 ' HA ' ' CG ' ' A' ' 69' ' ' GLU . 41.8 m -145.21 18.26 1.56 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.297 0.57 . . . . 0.0 110.517 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.37 -1.239 . . . . 0.0 112.434 -179.974 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.423 ' HB3' ' H ' ' B' ' 2' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.87 0.367 . . . . 0.0 111.045 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.525 ' O ' ' HB2' ' B' ' 3' ' ' ASP . 0.5 OUTLIER -63.04 -19.26 64.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.833 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.645 ' HB3' ' CD ' ' B' ' 23' ' ' GLU . 16.2 m-20 80.26 173.65 0.13 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.91 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.444 ' HB2' ' NH1' ' B' ' 4' ' ' ARG . 0.0 OUTLIER 63.78 -79.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.497 ' C ' HD13 ' B' ' 78' ' ' LEU . 0.8 OUTLIER 46.08 31.01 1.04 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.002 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.008 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.79 -177.94 4.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.27 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.904 HG12 ' HE2' ' B' ' 9' ' ' LYS . 72.9 t -141.85 68.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.553 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.884 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -38.58 150.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 -179.725 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.904 ' HE2' HG12 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -137.92 -15.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.991 179.497 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.5 OUTLIER -175.92 122.73 0.19 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.417 -179.864 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.623 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -149.03 102.08 3.22 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.788 0.328 . . . . 0.0 111.821 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.775 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -84.62 26.79 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.291 0.567 . . . . 0.0 109.857 178.893 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.876 ' HG2' ' N ' ' B' ' 14' ' ' SER . 0.1 OUTLIER -114.66 166.76 11.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.544 -179.586 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.876 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.3 OUTLIER -55.33 141.37 36.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.744 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.653 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -51.58 -56.59 12.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -28.73 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.686 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.751 ' HA ' ' OD2' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -75.56 -39.51 58.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.851 179.85 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.974 ' O ' HG23 ' B' ' 22' ' ' VAL . 0.0 OUTLIER -66.42 -29.25 69.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.052 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -77.55 -45.15 26.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.095 0.474 . . . . 0.0 109.818 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.751 ' OD2' ' HA ' ' B' ' 17' ' ' MET . 2.2 p30 -70.97 -27.72 63.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.741 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.787 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 96.2 p -68.88 -44.27 73.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.232 179.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.974 HG23 ' O ' ' B' ' 18' ' ' GLN . 40.6 t -62.67 -47.32 93.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.564 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.645 ' CD ' ' HB3' ' B' ' 3' ' ' ASP . 3.6 mm-40 -58.73 -35.05 72.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.69 -37.24 79.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.006 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.728 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -70.08 -31.14 68.57 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.7 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 23.8 m -71.0 -42.34 69.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.295 -1.321 . . . . 0.0 109.505 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.545 ' O ' ' HG3' ' B' ' 30' ' ' GLU . 1.7 mt-30 -51.97 -46.44 64.8 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.316 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.828 ' HB3' HG23 ' B' ' 38' ' ' ILE . . . -77.24 -19.83 56.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.172 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.837 HD11 HD11 ' B' ' 83' ' ' ILE . 5.2 mt -78.71 -25.22 44.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.938 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.545 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 1.2 pt-20 -90.28 -38.39 13.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.172 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.858 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.2 mmtp -77.52 -33.48 54.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.614 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.858 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -143.4 146.38 33.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.812 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.506 ' OD1' HD13 ' B' ' 34' ' ' ILE . 26.2 p30 -113.52 30.22 7.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.925 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 14.6 mm -106.78 105.98 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.676 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.873 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.3 mp0 -29.52 -67.48 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.605 ' HD3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -52.71 -56.96 11.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.886 0.374 . . . . 0.0 110.719 179.625 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.925 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.7 t0 -45.55 -65.43 0.54 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.743 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.828 HG23 ' HB3' ' B' ' 28' ' ' ALA . 8.2 mt -43.76 -58.94 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.114 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 1.035 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -45.96 -52.83 11.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.952 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.803 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -47.84 -66.11 0.46 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.967 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.58 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -45.86 -43.64 13.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.942 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.728 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 67.1 mt -54.85 -62.84 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.79 ' HB3' ' CE2' ' A' ' 65' ' ' TYR . 12.0 tttm -50.48 -37.28 37.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.752 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' B' ' 48' ' ' LYS . 0.3 OUTLIER -64.2 -46.99 81.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.093 -179.811 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.726 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 26.3 tt0 -73.25 -28.83 62.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.787 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -77.49 -36.17 52.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.768 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 4.0 m-20 -74.92 -30.49 61.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.098 0.475 . . . . 0.0 110.221 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.427 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -87.08 -40.78 14.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.753 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.726 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.9 ttmt -76.6 -27.34 55.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 -179.553 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.556 ' CD2' ' HE1' ' B' ' 17' ' ' MET . 16.7 m-85 -121.02 -68.52 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.339 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.497 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER 155.86 119.47 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 -179.523 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.768 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 19.7 Cg_endo -58.53 168.31 4.16 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 122.375 2.05 . . . . 0.0 112.645 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.623 HG21 HG21 ' A' ' 67' ' ' THR . 15.1 t -106.91 133.16 51.99 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.229 0.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.89 ' NE1' ' HE3' ' B' ' 87' ' ' LYS . 39.5 m95 -103.86 110.14 22.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.418 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.821 ' CE1' HG22 ' A' ' 67' ' ' THR . 3.5 m170 -82.57 95.62 7.82 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.678 ' O ' HD13 ' B' ' 57' ' ' ILE . 24.5 p -110.43 133.93 52.81 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.019 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.949 ' CG1' HD23 ' B' ' 84' ' ' LEU . 17.6 mm -125.15 115.23 43.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.704 178.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.035 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -116.87 119.13 61.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.024 0.44 . . . . 0.0 111.691 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.805 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -137.17 -125.98 2.47 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.809 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 0.7 OUTLIER -165.15 -6.1 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.671 0.272 . . . . 0.0 111.464 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 14.2 t-20 179.26 37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.856 0.36 . . . . 0.0 111.077 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.787 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.4 p90 -88.62 179.85 6.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.774 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -125.28 74.98 0.4 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.981 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.866 ' HA ' HG23 ' A' ' 57' ' ' ILE . 65.4 p -71.26 135.26 47.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.965 0.412 . . . . 0.0 111.514 -179.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.877 ' H ' HD13 ' A' ' 57' ' ' ILE . 18.4 t80 -146.83 71.16 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.458 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.854 HG21 ' CD2' ' B' ' 86' ' ' PHE . 17.9 m -104.59 163.73 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.097 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.617 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 20.0 m -103.02 103.94 14.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.15 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.535 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.7 OUTLIER -70.74 -158.36 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.535 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.4 OUTLIER 177.33 -87.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.056 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.5 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 2.0 m -37.97 -99.2 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.281 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.599 ' HB3' ' NZ ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 179.16 44.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.903 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.698 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 36.6 m80 -135.48 42.52 2.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.877 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.775 ' HD1' ' H ' ' B' ' 12' ' ' ASP . 2.7 t80 -113.6 106.83 14.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.419 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.837 HG23 ' HE1' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -121.81 144.83 29.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.641 -179.797 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -133.95 133.35 41.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.006 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.884 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.08 163.55 36.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.577 -179.344 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.684 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 11.5 t80 -120.79 105.25 10.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.737 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.008 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.3 mm? -69.86 170.77 10.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.605 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.73 -35.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.898 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.599 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -159.54 43.41 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.787 0.327 . . . . 0.0 110.854 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.805 HG13 ' O ' ' B' ' 59' ' ' GLY . 54.2 t -158.92 167.1 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.235 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.614 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -140.8 101.14 4.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.707 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.837 HD11 HD11 ' B' ' 29' ' ' LEU . 0.3 OUTLIER -84.61 150.06 4.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.374 -179.64 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.949 HD23 ' CG1' ' B' ' 57' ' ' ILE . 1.6 tp -135.64 84.88 2.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.716 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -87.91 137.46 32.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 110.948 179.816 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.854 ' CD2' HG21 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -171.64 124.23 0.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.897 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.89 ' HE3' ' NE1' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -96.62 149.35 21.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.799 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -109.97 20.41 17.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.302 0.572 . . . . 0.0 110.566 179.809 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.429 -1.206 . . . . 0.0 112.508 -179.987 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.768 0.318 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.56 ' O ' ' HG2' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -122.78 77.41 1.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.95 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 42.09 32.31 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.061 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 2' ' ' CYS . 1.9 mtm180 -86.03 -49.75 7.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.715 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' ARG . 0.7 OUTLIER 33.54 31.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.378 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.097 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.18 -169.61 2.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.217 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 77' ' ' TYR . 15.1 t -147.89 72.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.87 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.806 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.9 135.82 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.029 0.442 . . . . 0.0 110.355 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' HG12 ' A' ' 7' ' ' VAL . 8.5 mmpt? -113.59 -18.59 11.89 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.544 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.64 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -176.06 158.62 2.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.682 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 169.03 138.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.998 0.427 . . . . 0.0 111.685 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.791 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER -123.65 28.96 6.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.464 179.461 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.728 ' HG3' ' H ' ' A' ' 14' ' ' SER . 15.8 ttp -104.44 170.44 7.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.842 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.728 ' H ' ' HG3' ' A' ' 13' ' ' MET . 22.7 t -56.41 129.35 40.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.699 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.667 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.0 mm-40 -36.72 -67.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -48.58 -29.51 4.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.802 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.652 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.54 -31.91 62.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.791 179.799 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.979 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -72.83 -39.07 66.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.586 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.609 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 93.0 mt-30 -77.46 -34.09 54.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.763 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.0 OUTLIER -71.49 -36.25 71.07 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.603 179.12 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.999 ' HB2' HD22 ' A' ' 85' ' ' LEU . 1.2 p -64.34 -50.15 68.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.942 179.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.954 HG23 ' O ' ' A' ' 18' ' ' GLN . 16.4 t -54.98 -45.15 76.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.338 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.673 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 11.8 mt-10 -56.07 -41.05 74.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.35 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.63 -39.44 93.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.141 0.496 . . . . 0.0 110.027 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.769 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.22 -30.89 69.15 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.543 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -70.75 -36.95 73.37 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.498 178.543 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 72.8 mt-30 -59.52 -41.62 90.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.478 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.927 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -83.04 -22.57 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.688 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.737 HD12 ' C ' ' A' ' 25' ' ' ALA . 4.3 mt -76.28 -36.13 58.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.992 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.08 -29.65 19.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.837 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.667 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 20.6 mttt -83.63 -20.84 32.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.74 ' CE1' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -146.31 -172.52 3.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.586 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.09 27.48 0.36 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.103 0.478 . . . . 0.0 110.542 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.064 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 18.9 mm -114.57 104.64 17.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.772 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 3.5 mp0 -25.39 -77.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.393 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.501 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -46.17 -45.14 16.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.193 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 1.064 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -57.97 -60.14 4.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.936 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.927 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 4.3 mt -51.75 -54.78 11.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.985 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 1.041 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -53.78 -39.38 65.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.043 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.754 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.9 -63.12 1.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.123 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.74 ' CD2' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -54.76 -49.03 71.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.822 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.822 ' CG2' HD11 ' A' ' 85' ' ' LEU . 73.3 mt -44.39 -58.85 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.091 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.736 ' HE3' ' CE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -60.26 -61.61 2.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.682 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.569 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 10.6 mttt -36.71 -66.31 0.23 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.004 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.751 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mm-40 -49.16 -42.6 40.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.91 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -61.9 -42.71 99.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.165 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.733 ' HA ' ' CD1' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -65.55 -24.11 67.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.845 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.92 8.92 16.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.461 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.751 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 7.4 tttm -118.17 -1.52 11.35 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.718 ' CE1' ' HB3' ' A' ' 49' ' ' LYS . 10.9 m-85 -150.52 -62.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.363 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.695 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 17.3 t-20 164.82 115.46 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.291 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.723 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 18.9 Cg_endo -60.03 168.82 5.45 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.339 2.026 . . . . 0.0 112.593 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.789 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.9 m -101.82 137.34 40.25 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 110.3 0.032 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.84 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 76.5 m95 -106.12 140.42 39.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.517 0.675 . . . . 0.0 112.039 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.883 ' HE2' ' HB2' ' A' ' 88' ' ' SER . 0.4 OUTLIER -132.18 107.82 8.86 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.923 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 1.027 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -127.87 175.08 8.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.388 0.614 . . . . 0.0 112.198 -177.922 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.922 HG12 ' HA ' ' B' ' 64' ' ' SER . 60.8 mt -155.39 165.1 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.713 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.041 HG12 ' HB2' ' A' ' 39' ' ' ALA . 7.5 p -151.55 119.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.942 0.401 . . . . 0.0 110.984 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.479 ' O ' ' N ' ' A' ' 82' ' ' ALA . . . -143.91 -174.49 16.22 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.113 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.802 HH11 ' HG3' ' A' ' 60' ' ' ARG . 0.4 OUTLIER -150.88 30.06 0.65 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.825 0.345 . . . . 0.0 111.014 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.544 ' OD1' ' NH1' ' B' ' 60' ' ' ARG . 0.4 OUTLIER 172.14 27.5 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.793 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -111.07 -168.21 1.27 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.738 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -142.13 78.59 0.28 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.855 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.807 ' HA ' HG23 ' B' ' 57' ' ' ILE . 5.8 p -72.23 128.54 35.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.992 0.425 . . . . 0.0 111.231 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.871 ' H ' HD13 ' B' ' 57' ' ' ILE . 33.0 t80 -143.45 83.59 1.78 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.415 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.014 HG13 HD11 ' B' ' 57' ' ' ILE . 2.9 m -127.42 155.85 38.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.453 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.825 HG22 ' NE2' ' B' ' 55' ' ' HIS . 1.2 t -63.75 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.488 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.804 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -148.02 112.76 5.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.847 0.356 . . . . 0.0 111.198 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.738 ' CB ' ' HA ' ' A' ' 88' ' ' SER . 38.9 mm-40 -97.43 174.08 6.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.747 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.547 ' C ' ' H ' ' A' ' 72' ' ' HIS . 0.2 OUTLIER 38.02 -119.19 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.688 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.43 ' H ' ' HB ' ' A' ' 70' ' ' THR . 3.1 mttt -71.16 30.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.904 0.383 . . . . 0.0 110.832 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.804 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 15.1 m80 68.91 -88.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.008 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.793 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 162.55 -163.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.752 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.979 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.2 OUTLIER -169.64 111.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.617 179.515 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.445 ' CE1' ' OG ' ' A' ' 64' ' ' SER . 40.0 t80 -105.38 129.21 53.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.309 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.806 ' HB3' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -141.77 178.73 7.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.203 -179.849 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.847 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 5.3 t80 -140.18 102.75 4.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.097 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -67.88 -176.0 0.62 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.922 0.391 . . . . 0.0 111.043 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.545 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -55.82 88.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.278 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.631 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.4 OUTLIER 80.07 10.64 1.23 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.777 0.322 . . . . 0.0 110.863 -179.841 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.838 HG12 ' H ' ' A' ' 82' ' ' ALA . 4.4 t -136.22 177.49 6.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.248 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.969 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -148.55 159.7 43.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.969 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.5 OUTLIER -146.21 117.23 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.915 0.388 . . . . 0.0 111.707 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.948 HD21 ' HE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -99.64 100.02 10.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.301 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 1.027 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.5 OUTLIER -103.2 130.98 50.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.948 ' HE2' HD21 ' A' ' 84' ' ' LEU . 34.3 p90 -166.89 131.79 2.08 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.773 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.84 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 34.6 mtpt -86.2 -163.2 0.85 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.837 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.883 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 2.8 m -147.72 17.44 1.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.372 0.606 . . . . 0.0 110.366 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.401 ' N ' ' OG1' ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.353 -1.249 . . . . 0.0 112.531 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.0 tpt . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.699 0.285 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -155.53 125.2 6.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.909 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.596 ' O ' ' HG2' ' B' ' 23' ' ' GLU . 0.1 OUTLIER -104.79 142.99 33.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.661 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.832 ' HD2' ' N ' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -112.84 -21.96 10.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.912 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.632 ' CE ' ' HA ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 42.61 28.06 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.599 -179.822 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.097 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.15 -164.71 1.35 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.932 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 77' ' ' TYR . 14.7 t -151.5 75.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.126 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.904 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -40.11 156.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.59 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.642 ' HE3' ' HB3' ' B' ' 77' ' ' TYR . 0.0 OUTLIER -151.9 -8.84 0.21 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.526 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.589 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 4.0 t-20 -164.58 73.59 0.24 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.459 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.76 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -118.04 113.37 21.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.485 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.708 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 1.4 m-20 -114.29 32.58 5.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.379 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.887 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.0 OUTLIER -116.65 170.02 8.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.677 -179.68 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.882 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -49.32 129.59 18.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.627 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 47.8 mt-10 -38.32 -70.43 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.035 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.483 ' H ' ' HG2' ' B' ' 16' ' ' GLU . 3.3 mm-40 -48.64 -31.99 7.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.887 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -69.97 -38.59 76.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.883 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -67.31 -38.43 84.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.746 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.747 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 7.3 mm-40 -73.92 -35.83 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.772 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.612 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.5 OUTLIER -72.46 -30.81 64.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.806 179.189 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.794 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.4 OUTLIER -68.61 -42.36 78.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.294 179.487 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.827 HG23 ' O ' ' B' ' 18' ' ' GLN . 12.5 t -66.95 -38.04 80.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.438 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.747 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 18.8 mt-10 -63.78 -39.11 93.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.081 179.307 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 73.0 m -68.72 -34.25 75.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.915 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.844 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -73.14 -33.77 65.69 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.761 ' HA ' HD12 ' B' ' 29' ' ' LEU . 53.8 m -70.53 -38.43 74.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.296 178.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.407 ' HB3' ' CE1' ' B' ' 41' ' ' HIS . 37.4 mt-30 -58.52 -42.06 86.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.356 178.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.922 ' HB2' ' CD2' ' B' ' 41' ' ' HIS . . . -67.67 -35.85 79.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.133 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.844 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.1 mt -64.1 -38.86 92.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -30.62 59.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.175 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.545 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 1.0 OUTLIER -82.93 -29.48 29.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.875 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.564 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.75 169.04 21.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.629 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.694 ' C ' HD13 ' B' ' 34' ' ' ILE . 11.3 t30 -129.09 30.51 5.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.124 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 1.021 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.8 mm -116.73 106.29 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.918 ' HA ' HD12 ' B' ' 38' ' ' ILE . 1.1 mp0 -29.61 -70.35 0.05 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.769 0.318 . . . . 0.0 110.667 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.402 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -44.12 -43.95 7.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.589 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 1.021 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -64.06 -59.56 4.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.451 179.634 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 1.026 ' HB ' HG11 ' B' ' 58' ' ' VAL . 1.0 OUTLIER -45.35 -53.74 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.665 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.956 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.83 -49.11 50.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.821 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -53.86 -68.23 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.922 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.2 OUTLIER -37.59 -40.92 0.43 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.45 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.873 HG21 HD11 ' B' ' 85' ' ' LEU . 56.9 mt -68.15 -67.66 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.555 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.674 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 6.0 tttp -39.87 -53.42 2.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.267 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.641 ' HE2' ' OH ' ' A' ' 65' ' ' TYR . 23.7 mttm -60.33 -43.98 95.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.415 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.77 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 50.0 tp10 -62.12 -37.2 84.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.296 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.794 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.36 -34.95 73.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.118 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.726 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.3 OUTLIER -68.73 -35.49 77.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.807 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.58 -23.52 21.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.138 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.77 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.97 -26.43 21.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.643 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 1.4 m-85 -127.94 -62.45 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.171 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.643 ' HB3' ' O ' ' B' ' 50' ' ' TYR . 40.2 p-10 154.96 117.12 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.828 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.726 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 10.8 Cg_endo -53.92 169.45 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 122.351 2.034 . . . . 0.0 112.191 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.589 HG21 ' HB ' ' A' ' 67' ' ' THR . 5.8 m -111.37 124.92 53.24 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 122.866 0.467 . . . . 0.0 110.705 0.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.678 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 33.6 m95 -97.53 146.75 24.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.723 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.825 ' NE2' HG22 ' A' ' 67' ' ' THR . 10.5 m170 -111.07 98.79 7.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.108 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.626 ' O ' ' HB1' ' B' ' 39' ' ' ALA . 43.6 t -103.58 124.05 48.08 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -177.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 1.014 HD11 HG13 ' A' ' 66' ' ' VAL . 21.2 mm -121.92 102.54 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.127 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.026 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.6 p -107.24 121.87 60.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.678 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.733 ' O ' ' HB3' ' B' ' 60' ' ' ARG . . . -146.64 -97.24 0.2 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.05 -0.595 . . . . 0.0 111.773 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.733 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 7.8 ptt180 167.59 -27.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -158.6 46.69 0.32 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.667 0.27 . . . . 0.0 111.407 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.793 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 14.8 p90 -96.37 175.41 6.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.659 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.646 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -117.0 83.94 0.36 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.947 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.922 ' HA ' HG12 ' A' ' 57' ' ' ILE . 0.3 OUTLIER -75.73 133.12 40.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 111.432 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.868 ' H ' HG12 ' A' ' 57' ' ' ILE . 22.4 t80 -142.45 61.08 1.44 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.199 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.774 ' HB ' ' CZ ' ' B' ' 86' ' ' PHE . 33.2 m -108.6 168.65 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.678 -179.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.515 ' O ' ' CE1' ' A' ' 55' ' ' HIS . 81.8 m -130.72 107.7 9.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.93 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.805 ' CE1' ' HG3' ' B' ' 87' ' ' LYS . 2.3 t-80 -63.92 -143.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.644 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER 171.21 15.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.668 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.899 HG21 ' NZ ' ' B' ' 87' ' ' LYS . 98.0 m -141.97 -96.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.082 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.846 ' HG2' ' HG3' ' B' ' 13' ' ' MET . 0.0 OUTLIER -87.31 14.69 7.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.268 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.708 ' CG ' ' HB3' ' B' ' 12' ' ' ASP . 47.7 m80 76.99 -78.84 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.722 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 12.4 p90 156.5 -169.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.34 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.929 HG23 ' HE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -157.35 114.11 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.021 0.439 . . . . 0.0 111.617 179.804 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.616 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 0.1 OUTLIER -102.27 137.24 40.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.236 179.435 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.929 ' HE1' HG23 ' B' ' 74' ' ' ILE . 0.4 OUTLIER -160.64 159.22 30.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.916 0.389 . . . . 0.0 111.307 -179.821 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.642 ' HB3' ' HE3' ' B' ' 9' ' ' LYS . 7.8 t80 -125.07 112.59 16.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.097 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -71.65 170.5 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.489 179.553 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.543 ' O ' ' HG3' ' B' ' 80' ' ' GLN . . . -24.44 -40.18 0.01 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 121.211 -0.518 . . . . 0.0 113.037 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' B' ' 78' ' ' LEU . 78.3 mt-30 -157.56 40.1 0.29 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.867 0.365 . . . . 0.0 110.803 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.729 HG13 ' O ' ' B' ' 59' ' ' GLY . 98.6 t -154.73 169.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.123 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.842 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -132.36 151.96 51.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.331 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.842 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.2 OUTLIER -140.09 134.55 36.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.076 0.465 . . . . 0.0 111.589 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.938 HD23 ' CG1' ' B' ' 57' ' ' ILE . 0.3 OUTLIER -123.84 97.61 5.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.108 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.873 HD11 HG21 ' B' ' 42' ' ' ILE . 0.5 OUTLIER -100.85 131.62 46.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.975 0.417 . . . . 0.0 111.541 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.774 ' CZ ' ' HB ' ' B' ' 66' ' ' VAL . 0.4 OUTLIER -172.34 123.97 0.49 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.586 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.899 ' NZ ' HG21 ' B' ' 70' ' ' THR . 0.0 OUTLIER -82.29 161.82 22.5 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.779 0.323 . . . . 0.0 110.721 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.687 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -107.57 19.12 20.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.231 0.538 . . . . 0.0 110.767 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 89' ' ' GLY . . . . . 0.473 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.427 -1.207 . . . . 0.0 112.412 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.636 ' HG3' ' H ' ' A' ' 2' ' ' CYS . 3.5 tpt . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.877 0.37 . . . . 0.0 111.244 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.636 ' H ' ' HG3' ' A' ' 1' ' ' MET . 0.7 OUTLIER 32.5 -147.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.04 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 5' ' ' LYS . 2.3 p30 -163.33 -156.75 0.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.81 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.604 ' HB3' ' OE1' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -54.33 84.59 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.991 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.517 ' HE3' ' HA ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -115.72 50.96 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.838 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.13 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.5 173.9 9.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.369 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.921 HG12 ' HE3' ' A' ' 9' ' ' LYS . 47.9 t -123.92 71.49 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.726 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.992 HD11 HD11 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -41.37 162.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.077 -179.745 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.921 ' HE3' HG12 ' A' ' 7' ' ' VAL . 2.5 mmtt -155.12 -11.3 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 75' ' ' TYR . 6.1 t-20 -176.22 94.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.616 -179.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.903 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.32 84.95 2.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.637 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.746 ' H ' ' HD1' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -73.79 34.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.01 0.433 . . . . 0.0 110.407 179.4 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.768 ' HG3' ' H ' ' A' ' 14' ' ' SER . 12.1 ttp -127.69 170.4 12.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.948 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.768 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.3 OUTLIER -61.91 128.8 37.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.837 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.741 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -34.07 -78.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.15 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.439 ' OE1' ' HG2' ' A' ' 17' ' ' MET . 0.0 OUTLIER -37.21 -35.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.993 -179.896 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.659 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -70.87 -41.6 71.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.166 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.884 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -66.91 -35.33 79.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.604 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 42.5 mm-40 -73.99 -37.92 64.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.139 0.495 . . . . 0.0 109.812 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.25 -31.02 62.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.022 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.777 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -67.8 -40.77 83.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.242 179.308 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.8 HG22 ' CE2' ' A' ' 76' ' ' PHE . 64.0 t -65.52 -50.8 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.604 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 13.3 mt-10 -53.61 -38.79 64.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -37.13 76.59 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.791 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.743 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -68.09 -25.12 65.16 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.114 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.592 ' HA ' HD12 ' A' ' 29' ' ' LEU . 4.2 m -74.93 -45.31 43.29 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.043 -1.435 . . . . 0.0 109.784 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.752 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 53.8 mt-30 -51.82 -47.37 64.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.85 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.782 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -74.42 -26.36 60.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.199 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.937 HD21 HG11 ' A' ' 81' ' ' VAL . 6.6 mt -67.15 -43.58 81.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.14 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.416 ' OE1' ' HG2' ' A' ' 1' ' ' MET . 16.3 mt-10 -94.13 -10.84 31.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.12 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.755 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 3.7 mttp -85.01 -21.75 29.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 110.588 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.755 ' CE1' ' HB3' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -148.57 -54.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.452 179.374 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.717 ' C ' HD12 ' A' ' 34' ' ' ILE . 1.6 t-20 80.38 26.78 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.385 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.79 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -111.69 91.03 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.851 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.711 ' HG2' ' HA2' ' A' ' 59' ' ' GLY . 3.1 mp0 -14.05 -85.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 O-C-N 123.603 0.564 . . . . 0.0 111.685 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.49 -49.97 2.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.816 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.79 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -57.6 -60.1 4.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.641 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.866 HG22 HD11 ' A' ' 42' ' ' ILE . 51.7 mt -44.43 -51.86 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.91 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -55.9 -38.9 70.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.005 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.774 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -60.41 -66.36 0.54 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.868 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.641 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -50.86 -49.68 58.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.866 HD11 HG22 ' A' ' 38' ' ' ILE . 94.2 mt -50.24 -52.83 13.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.032 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.913 ' HE3' ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -61.75 -70.2 0.2 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.774 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -30.99 -50.31 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' A' ' 49' ' ' LYS . 3.6 mt-10 -63.84 -67.1 0.46 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.795 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.777 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -40.16 -39.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.783 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.751 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 9.8 t70 -68.29 -42.57 79.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.027 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -99.0 9.54 43.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.166 -179.789 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.56 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -117.32 -23.58 7.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.124 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.766 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 84.4 m-85 -120.79 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.272 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.766 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 13.7 t30 162.68 111.81 0.01 OUTLIER Pre-proline 0 N--CA 1.454 -0.245 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.094 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.751 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 81.8 Cg_exo -44.92 156.39 0.25 Allowed 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.372 2.048 . . . . 0.0 112.378 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.685 ' HA ' ' OD1' ' A' ' 47' ' ' ASP . 6.8 m -112.46 138.64 48.92 Favored 'General case' 0 C--N 1.345 0.41 0 C-N-CA 123.037 0.535 . . . . 0.0 110.511 -0.046 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.805 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 70.8 m95 -108.43 140.87 41.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.446 0.641 . . . . 0.0 112.488 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.885 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.1 OUTLIER -135.13 104.41 5.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.836 178.631 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.913 ' HB3' ' HE3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -120.91 165.64 14.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.557 0.694 . . . . 0.0 112.79 -177.676 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.055 HG13 HD23 ' A' ' 84' ' ' LEU . 17.4 mm -132.51 165.21 32.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.601 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.6 p -162.47 108.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.918 0.39 . . . . 0.0 111.541 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.779 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -141.83 -114.62 1.08 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.728 ' HB3' ' O ' ' A' ' 59' ' ' GLY . 0.7 OUTLIER 166.68 -12.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.636 0.255 . . . . 0.0 111.657 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -157.78 40.27 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.672 0.272 . . . . 0.0 111.128 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 1.022 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -106.69 -169.5 1.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.951 0.405 . . . . 0.0 111.021 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.892 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.59 86.4 0.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.974 ' HB2' HD22 ' A' ' 84' ' ' LEU . 70.6 p -81.19 129.23 34.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.209 0.528 . . . . 0.0 111.779 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.782 ' H ' HD13 ' B' ' 57' ' ' ILE . 15.7 t80 -137.65 70.65 1.39 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.067 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.001 HG13 HD11 ' B' ' 57' ' ' ILE . 3.4 m -100.56 166.62 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.709 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.714 HG21 ' OG1' ' B' ' 53' ' ' THR . 1.4 m -114.32 68.53 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.57 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.5 ' NE2' ' CB ' ' A' ' 12' ' ' ASP . 37.0 p-80 -62.85 -167.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.571 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.511 ' HB2' ' H ' ' A' ' 70' ' ' THR . 0.7 OUTLIER -176.15 -140.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.786 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.515 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER 36.76 -99.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.265 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.748 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 175.1 27.04 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.893 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.717 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 98.4 m-70 -119.4 49.14 1.39 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.435 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.746 ' HD1' ' H ' ' A' ' 12' ' ' ASP . 0.3 OUTLIER -128.15 126.44 41.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 -179.7 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.992 HD11 HD11 ' A' ' 8' ' ' ILE . 1.4 tt -134.72 137.48 50.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.997 0.427 . . . . 0.0 111.342 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 10' ' ' ASN . 16.8 t80 -124.06 129.67 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.036 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.971 ' HE1' HG23 ' A' ' 74' ' ' ILE . 0.5 OUTLIER -159.1 167.7 28.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.01 0.433 . . . . 0.0 111.358 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.661 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 28.2 t80 -131.21 93.29 3.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.546 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.13 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -48.87 175.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.957 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -29.66 -54.27 0.19 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.665 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.41 32.65 1.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.865 0.364 . . . . 0.0 110.961 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.937 HG11 HD21 ' A' ' 29' ' ' LEU . 60.1 t -146.49 170.85 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.056 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.924 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -131.48 153.43 49.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.713 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.924 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -144.27 121.57 5.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.925 0.393 . . . . 0.0 111.42 -179.786 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.055 HD23 HG13 ' A' ' 57' ' ' ILE . 3.2 tp -112.41 90.74 3.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.317 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.774 ' HG ' ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -94.76 146.21 24.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.87 -179.32 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.728 ' HB3' ' HD2' ' A' ' 73' ' ' PHE . 7.8 p90 177.21 140.56 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.936 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.851 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 6.4 mtpm? -99.18 -179.03 4.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.987 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.885 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -124.59 19.81 8.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.265 0.555 . . . . 0.0 110.723 179.833 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.472 ' O ' ' NZ ' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.379 -1.234 . . . . 0.0 112.538 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.438 ' O ' ' C ' ' B' ' 2' ' ' CYS . 2.5 ttp . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.842 0.353 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.438 ' C ' ' O ' ' B' ' 1' ' ' MET . 0.2 OUTLIER -34.27 -72.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.513 ' HB2' ' H ' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -129.47 -97.96 0.36 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.962 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.724 HH22 HD13 ' B' ' 8' ' ' ILE . 0.2 OUTLIER 67.27 -71.33 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.009 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' B' ' 5' ' ' LYS . 11.1 mmmt 39.45 28.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.531 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.006 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.44 -167.47 1.77 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.067 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.694 ' O ' ' HE2' ' B' ' 9' ' ' LYS . 75.7 t -152.88 74.33 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.972 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.815 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -42.84 159.78 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.236 0.541 . . . . 0.0 110.861 -179.857 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.694 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 5.7 mmtt -152.15 -14.73 0.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.896 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.579 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.9 OUTLIER -171.4 108.69 0.27 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.778 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.784 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -141.61 102.77 4.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.876 0.37 . . . . 0.0 111.653 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.792 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 1.7 t70 -85.77 26.28 0.99 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.439 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.884 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 11.0 ttp -114.89 157.53 23.2 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.743 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.745 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -46.24 152.6 0.4 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.619 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.894 ' HA ' HE21 ' B' ' 18' ' ' GLN . 2.5 mt-10 -56.48 -70.27 0.12 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.127 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.463 ' HA ' ' HG2' ' B' ' 19' ' ' GLN . 0.8 OUTLIER -49.58 -25.67 2.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.989 0.423 . . . . 0.0 110.533 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.797 ' HE2' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -74.3 -41.9 60.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.828 179.796 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.894 HE21 ' HA ' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -68.47 -25.37 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.68 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.702 ' HG3' ' N ' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -78.46 -39.98 36.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.016 179.498 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.702 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 0.3 OUTLIER -72.96 -24.4 60.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.053 179.213 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.793 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -74.4 -48.04 30.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.27 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.848 HG13 ' CE2' ' B' ' 76' ' ' PHE . 37.4 t -61.91 -39.76 84.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.463 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.527 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 68.7 mt-10 -66.12 -38.81 89.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.067 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' B' ' 20' ' ' ASP . 99.2 m -67.62 -35.25 78.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.712 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.76 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -69.49 -35.8 75.9 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 178.172 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.819 ' HA ' HD12 ' B' ' 29' ' ' LEU . 88.2 m -65.05 -42.12 94.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.522 178.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 32.5 mt-30 -54.35 -46.81 73.05 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.585 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.78 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -74.01 -16.89 61.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.186 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' B' ' 26' ' ' THR . 3.3 mt -80.66 -41.33 23.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.107 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -78.75 -30.22 45.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.799 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.681 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 7.8 mmtp -84.4 -19.46 33.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.623 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.681 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -158.34 149.89 21.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.813 179.679 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.31 27.45 9.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.7 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 1.017 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.3 mm -108.43 106.42 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.928 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.892 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 35.7 mp0 -30.24 -70.71 0.05 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.527 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.33 -60.31 2.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.691 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 1.017 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.1 OUTLIER -44.48 -65.41 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.55 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.78 HG23 ' CB ' ' B' ' 28' ' ' ALA . 10.9 mt -46.64 -45.12 7.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.325 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -61.99 -43.77 98.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.394 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.531 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -60.82 -64.86 0.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.689 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -42.37 -56.14 3.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.76 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 55.7 mt -46.82 -68.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.637 ' HD3' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -36.45 -57.15 0.77 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.265 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -52.61 -39.74 61.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.462 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.593 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -73.53 -41.88 62.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.196 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.793 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.9 -37.39 87.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.74 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.858 ' HB3' ' HG3' ' B' ' 52' ' ' PRO . 8.0 m-20 -68.32 -46.24 70.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' B' ' 48' ' ' LYS . 22.0 mmmt -79.19 -25.11 42.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.6 tttm -90.16 -12.44 38.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.155 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.55 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 86.0 m-85 -133.39 -71.43 0.51 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.344 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.9 m-20 157.85 107.46 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.069 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.858 ' HG3' ' HB3' ' B' ' 47' ' ' ASP . 72.0 Cg_exo -35.58 156.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.52 2.147 . . . . 0.0 112.691 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.735 HG23 ' CE1' ' B' ' 55' ' ' HIS . 4.7 t -120.94 123.26 42.04 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 123.016 0.527 . . . . 0.0 111.006 -0.02 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.962 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 37.6 m95 -92.79 118.99 31.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.915 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.812 ' HE2' ' HB2' ' B' ' 88' ' ' SER . 1.9 m-70 -99.54 99.39 10.26 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.764 ' CB ' HD12 ' B' ' 85' ' ' LEU . 24.4 p -114.96 146.39 41.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.264 0.554 . . . . 0.0 112.471 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 1.001 HD11 HG13 ' A' ' 66' ' ' VAL . 22.7 mm -128.19 111.51 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.184 178.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -111.11 135.24 50.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.877 0.37 . . . . 0.0 111.634 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.594 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -165.22 -137.52 2.22 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.967 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.593 ' O ' ' ND2' ' B' ' 61' ' ' ASN . 0.1 OUTLIER -172.33 34.07 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 120.775 0.321 . . . . 0.0 111.269 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.593 ' ND2' ' O ' ' B' ' 60' ' ' ARG . 0.6 OUTLIER 163.81 27.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.776 179.815 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 1.022 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.7 p90 -100.67 165.81 11.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.661 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -121.12 84.29 0.37 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.976 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.905 ' CB ' HD22 ' B' ' 84' ' ' LEU . 3.0 p -79.76 139.27 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.006 0.432 . . . . 0.0 111.444 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.82 ' H ' HD13 ' A' ' 57' ' ' ILE . 4.1 t80 -149.17 64.18 1.03 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.446 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.703 ' HA ' ' HB3' ' A' ' 55' ' ' HIS . 24.3 m -101.78 140.79 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.532 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 17.4 m -85.33 95.43 9.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.612 ' HB3' ' CG ' ' B' ' 73' ' ' PHE . 14.8 p-80 -57.52 -150.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.809 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.727 ' O ' HG22 ' B' ' 70' ' ' THR . 0.0 OUTLIER 168.73 116.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 70' ' ' THR . . . . . 1.092 HG23 ' HG2' ' B' ' 71' ' ' LYS . 0.5 OUTLIER 81.01 -59.4 0.26 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.476 179.625 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 1.092 ' HG2' HG23 ' B' ' 70' ' ' THR . 0.0 OUTLIER 174.53 -158.44 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.874 -179.756 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.884 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 29.7 m170 64.1 17.77 10.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.855 ' HA ' ' HA ' ' B' ' 86' ' ' PHE . 4.0 t80 -114.26 77.36 1.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.478 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.789 HD13 ' CE1' ' B' ' 76' ' ' PHE . 1.6 tt -96.0 149.05 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.126 0.489 . . . . 0.0 111.469 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.579 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.3 OUTLIER -140.79 125.5 18.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.619 179.145 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.848 ' CE2' HG13 ' B' ' 22' ' ' VAL . 4.5 p90 -155.3 167.38 30.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.975 0.417 . . . . 0.0 111.24 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 10.9 t80 -124.06 111.02 15.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.976 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.006 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -72.65 170.48 14.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.678 179.711 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.498 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.23 -50.0 0.05 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.695 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -146.05 37.59 1.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.958 0.409 . . . . 0.0 110.692 179.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.817 HG11 HD21 ' B' ' 29' ' ' LEU . 93.3 t -152.08 170.4 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.863 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.709 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -142.66 115.01 8.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 0.0 110.919 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.71 HD13 HG23 ' B' ' 58' ' ' VAL . 0.4 OUTLIER -101.75 129.77 52.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.253 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.905 HD22 ' CB ' ' B' ' 64' ' ' SER . 0.3 OUTLIER -118.2 87.14 2.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.532 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.764 HD12 ' CB ' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -89.46 134.62 34.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.855 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -160.27 126.86 4.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.962 ' HG3' ' HA ' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -110.32 142.95 41.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.024 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.812 ' HB2' ' HE2' ' B' ' 55' ' ' HIS . 0.2 OUTLIER -86.21 19.35 2.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.211 0.529 . . . . 0.0 110.729 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.421 -1.21 . . . . 0.0 112.506 179.901 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.776 0.322 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.3 m -93.07 -61.84 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.816 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 5' ' ' LYS . 40.8 t0 70.1 71.33 0.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.866 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.717 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER 53.27 -87.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.974 -179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.672 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.0 OUTLIER 56.82 97.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.807 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.998 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 160.59 168.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.915 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.672 HG12 ' O ' ' A' ' 7' ' ' VAL . 98.8 t -131.13 60.75 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.929 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.859 HD11 HD11 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -36.04 132.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.694 -179.897 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -114.33 -16.29 12.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.984 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.595 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 1.7 m-20 -173.99 160.06 3.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.665 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.595 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 171.07 113.86 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.778 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.732 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 41.6 m-20 -98.52 27.62 4.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.024 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.896 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -107.59 168.02 9.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.562 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.896 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -53.69 146.83 12.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.882 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.721 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -56.53 -62.01 2.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.764 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' ' 16' ' ' GLU . 2.6 mp0 -53.96 -24.99 18.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.857 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.586 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 60.2 mmm -77.67 -45.86 23.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.99 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.854 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -61.77 -33.16 73.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.72 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.717 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 4.7 mt-30 -75.53 -40.37 57.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.149 0.499 . . . . 0.0 109.7 179.292 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.766 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 1.4 m-20 -69.73 -30.81 68.5 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.548 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -64.45 -50.31 68.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.824 179.198 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.775 HG22 ' CD2' ' A' ' 76' ' ' PHE . 70.3 t -55.43 -47.4 78.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.009 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -53.73 -39.3 65.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.161 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.53 ' HG ' ' HD1' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -65.43 -41.32 93.64 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.045 179.24 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.668 ' HB2' HG21 ' A' ' 83' ' ' ILE . . . -66.69 -28.94 68.85 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.685 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.6 OUTLIER -72.73 -42.25 64.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.641 178.655 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -51.62 -46.06 63.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.528 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.926 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -81.07 -20.55 41.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.683 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.739 HD11 ' HG ' ' A' ' 78' ' ' LEU . 6.7 mt -77.46 -29.93 52.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.249 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 -34.77 14.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.204 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.563 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -82.9 -14.14 54.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.449 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.633 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.35 169.7 22.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.761 179.535 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.725 ' C ' HD13 ' A' ' 34' ' ' ILE . 1.3 t30 -137.93 29.18 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.913 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 1.2 mm -116.63 108.22 24.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.065 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.682 ' HA ' HD12 ' A' ' 38' ' ' ILE . 23.6 mp0 -29.1 -74.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.503 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.4 OUTLIER -42.61 -61.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.753 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.913 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.3 OUTLIER -44.43 -62.85 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.926 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 3.3 mt -45.18 -48.46 3.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.868 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -57.94 -43.85 86.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.071 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.799 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.94 -64.77 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.067 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.692 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -49.15 -56.8 8.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.931 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.815 HD11 HG22 ' A' ' 38' ' ' ILE . 47.3 mt -42.52 -62.52 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.952 ' HE2' ' H ' ' A' ' 54' ' ' TRP . 13.0 tptp -51.49 -60.44 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.01 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -36.93 -56.02 0.89 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.069 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 48' ' ' LYS . 18.3 tt0 -60.97 -69.06 0.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.3 OUTLIER -37.35 -38.16 0.22 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.315 -179.84 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.708 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.1 OUTLIER -71.58 -38.52 70.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.471 -179.467 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.478 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -101.64 9.96 40.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.723 0.297 . . . . 0.0 111.373 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.42 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -125.54 -7.48 6.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.323 -179.899 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.766 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 39.8 m-85 -133.04 -63.3 0.77 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.994 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 1.0 OUTLIER 161.79 108.86 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.313 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.708 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 73.0 Cg_exo -49.53 153.56 5.11 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.446 2.097 . . . . 0.0 112.434 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . 1.027 HG21 HG21 ' B' ' 67' ' ' THR . 44.5 m -117.06 137.11 52.48 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 122.998 0.519 . . . . 0.0 110.699 0.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.952 ' H ' ' HE2' ' A' ' 43' ' ' LYS . 64.8 m95 -98.76 160.81 14.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.39 0.614 . . . . 0.0 111.748 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.859 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 1.7 m80 -141.26 100.42 3.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.016 179.247 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.943 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.8 OUTLIER -113.27 144.35 42.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.355 0.597 . . . . 0.0 112.573 -178.051 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.976 HG12 HD23 ' A' ' 84' ' ' LEU . 18.0 mm -132.87 111.82 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.334 179.039 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.868 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.8 p -111.01 126.83 68.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.933 0.397 . . . . 0.0 111.58 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.609 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -147.48 -151.34 5.4 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.677 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.5 26.02 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.773 0.287 . . . . 0.0 111.586 -179.75 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.677 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 164.5 26.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 0.0 111.143 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.861 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 14.8 p90 -102.67 -179.54 4.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.842 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.786 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -132.6 108.57 0.78 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.785 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.861 ' HB3' ' HE1' ' A' ' 62' ' ' PHE . 7.2 p -93.94 124.75 38.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.982 0.42 . . . . 0.0 111.53 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.814 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 33.1 t80 -135.8 82.14 1.93 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.376 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.851 HG13 HD11 ' B' ' 57' ' ' ILE . 14.6 m -125.89 152.27 32.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.4 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . 1.032 HG21 HG21 ' B' ' 53' ' ' THR . 0.6 OUTLIER -79.49 115.71 19.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.617 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.821 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -74.87 148.41 40.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.96 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.752 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 3.5 mm-40 -113.94 -131.52 0.32 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.481 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.583 ' OG1' ' N ' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -27.57 -99.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.679 -179.56 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.751 ' O ' ' HB2' ' A' ' 13' ' ' MET . 0.1 OUTLIER -70.29 22.49 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.962 0.41 . . . . 0.0 110.697 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.821 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 24.6 m-70 56.97 -85.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.874 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.744 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 164.61 -170.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.895 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.859 HD11 HD11 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -160.34 110.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.597 179.771 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.597 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 34.6 t80 -103.71 137.26 42.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.605 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.84 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.5 OUTLIER -151.17 169.73 21.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.81 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.777 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 10.2 t80 -126.59 98.11 5.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.002 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.998 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.3 OUTLIER -59.46 177.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.73 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.546 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -56.63 81.4 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.464 179.334 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.777 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.7 OUTLIER 84.1 22.87 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.177 0.513 . . . . 0.0 110.016 -178.9 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.907 ' HB ' ' HB2' ' A' ' 78' ' ' LEU . 72.5 t -142.63 173.02 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.75 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.756 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -146.25 146.26 30.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.695 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.817 HD13 HG23 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -135.79 133.1 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.008 0.432 . . . . 0.0 111.531 -179.517 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.976 HD23 HG12 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -118.34 93.96 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.045 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.766 HD11 HG21 ' A' ' 42' ' ' ILE . 0.7 OUTLIER -98.81 124.67 43.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.636 -179.155 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.782 ' CE1' HG21 ' A' ' 66' ' ' VAL . 18.7 p90 -162.72 129.95 3.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.049 179.43 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.835 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 1.0 OUTLIER -104.87 151.17 24.16 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.926 0.393 . . . . 0.0 111.159 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.808 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 1.0 OUTLIER -109.87 19.02 19.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.329 0.585 . . . . 0.0 110.741 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.415 -1.214 . . . . 0.0 112.593 -179.888 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.482 ' O ' ' C ' ' B' ' 2' ' ' CYS . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.861 0.363 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.482 ' C ' ' O ' ' B' ' 1' ' ' MET . 63.0 m 32.14 91.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.565 ' O ' ' HD3' ' B' ' 4' ' ' ARG . 10.9 m-20 -118.64 61.89 0.78 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.935 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.565 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 27.0 mmt-85 -129.43 -66.01 0.83 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.965 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.505 ' O ' HG11 ' B' ' 22' ' ' VAL . 0.0 OUTLIER 72.51 174.36 0.29 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.828 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.03 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 66.06 164.64 0.18 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.422 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.601 ' O ' ' HG2' ' B' ' 9' ' ' LYS . 24.3 t -130.43 71.9 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.739 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.814 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -32.08 152.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.77 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.824 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 1.8 mmpt? -147.16 -6.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.511 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.602 ' HB3' ' HZ ' ' B' ' 73' ' ' PHE . 3.3 m-20 -176.65 90.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.516 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.878 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -127.98 97.74 4.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.423 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.83 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 1.4 m-20 -95.07 25.96 3.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.067 0.46 . . . . 0.0 110.393 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.726 ' HG3' ' H ' ' B' ' 14' ' ' SER . 12.8 ttp -110.4 168.78 9.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.544 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.726 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.6 OUTLIER -49.24 125.83 11.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.766 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.723 ' HA ' HE21 ' B' ' 18' ' ' GLN . 45.9 mt-10 -39.29 -56.37 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.785 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -56.41 -30.6 62.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.532 ' CB ' ' HG2' ' B' ' 13' ' ' MET . 30.8 mmm -72.82 -44.09 61.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.071 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 1.032 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -62.94 -32.39 73.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -75.03 -42.77 56.56 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.196 0.522 . . . . 0.0 109.682 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.55 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 25.1 m-20 -68.1 -28.87 67.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.511 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.786 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -66.67 -48.62 68.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.956 179.094 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.825 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 90.9 t -55.27 -50.15 66.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.136 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.83 -34.99 68.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.948 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.473 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 3.2 m -69.55 -36.12 76.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.754 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.77 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.36 -28.81 64.32 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 3.7 m -74.31 -40.39 62.27 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.75 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.769 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 6.9 mm100 -56.6 -44.43 81.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.681 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.978 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -68.21 -36.7 79.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.067 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.77 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.8 mt -65.46 -41.08 93.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -25.88 54.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.736 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.769 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 23.6 mmtm -88.12 -22.65 23.99 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.687 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.53 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -159.66 163.71 34.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.699 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.469 ' OD1' ' N ' ' B' ' 33' ' ' ASN . 0.0 OUTLIER -123.28 29.75 6.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.935 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.746 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.7 mm -113.67 106.41 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.892 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.786 ' HB3' ' HA3' ' A' ' 63' ' ' GLY . 1.2 mp0 -29.89 -70.34 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.898 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.438 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -43.33 -52.33 5.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.633 179.559 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.746 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 7.0 t0 -55.49 -60.49 3.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.369 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.978 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 3.8 mt -42.74 -55.1 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.713 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.98 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.46 -53.73 21.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.814 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -51.37 -69.29 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.263 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.755 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -33.78 -42.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.359 179.134 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.747 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 53.6 mt -69.04 -66.35 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.324 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.596 ' HD3' ' CD1' ' A' ' 65' ' ' TYR . 7.3 tttp -40.49 -43.55 1.86 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.075 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -69.02 -49.4 58.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.277 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.561 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 41.6 tt0 -63.22 -25.95 68.57 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.786 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -79.33 -37.81 36.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.874 0.369 . . . . 0.0 110.771 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.933 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.62 -32.82 73.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.609 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.4 mmmt -90.56 -33.78 15.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.221 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 7.7 tttp -81.03 -12.66 59.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.387 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.751 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 17.4 m-85 -142.75 -66.59 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.658 0.266 . . . . 0.0 111.596 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.751 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.2 t30 160.74 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.398 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.933 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 21.0 Cg_endo -60.43 169.42 5.29 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.472 2.115 . . . . 0.0 112.377 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' THR . . . . . 1.032 HG21 HG21 ' A' ' 67' ' ' THR . 1.8 t -110.89 120.73 43.37 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 122.926 0.49 . . . . 0.0 110.733 0.077 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.856 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 31.2 m95 -90.55 141.23 28.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.46 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.815 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 4.1 m170 -107.1 105.39 15.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.338 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.69 ' O ' HD13 ' B' ' 57' ' ' ILE . 9.8 t -111.74 133.08 54.21 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.156 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.997 ' CG1' HD23 ' B' ' 84' ' ' LEU . 23.8 mm -127.08 99.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.56 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 0.98 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.6 p -104.98 118.78 52.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.048 0.451 . . . . 0.0 111.847 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.905 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -134.87 -116.03 1.59 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.198 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -174.15 -31.86 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.786 0.327 . . . . 0.0 111.022 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -154.67 43.11 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.925 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.913 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 27.9 p90 -99.68 -167.15 1.42 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 0.0 111.07 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.681 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -140.5 98.11 0.23 Allowed Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.709 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.941 ' CB ' HD22 ' B' ' 84' ' ' LEU . 3.8 p -89.22 128.42 35.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.996 0.427 . . . . 0.0 111.668 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.799 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 52.5 t80 -139.48 86.54 2.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.343 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.922 HG13 HD11 ' A' ' 57' ' ' ILE . 12.2 m -136.92 141.42 40.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.179 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 67' ' ' THR . . . . . 1.027 HG21 HG21 ' A' ' 53' ' ' THR . 1.3 t -70.37 139.54 51.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.043 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.783 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -98.76 162.15 13.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.532 ' HB2' ' H ' ' B' ' 70' ' ' THR . 0.1 OUTLIER -131.75 -101.26 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.33 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.557 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -46.04 -108.08 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.389 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.687 ' O ' ' HB2' ' B' ' 13' ' ' MET . 2.1 mmtp -70.5 29.3 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.88 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.83 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 37.9 m-70 57.22 -83.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.778 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 163.05 -153.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.73 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 1.032 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.6 OUTLIER -172.54 135.6 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.549 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.824 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 5.2 t80 -124.05 139.62 53.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.999 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.825 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 0.8 OUTLIER -165.73 147.11 7.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.977 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.723 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 64.5 t80 -112.7 109.5 19.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.03 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.4 mm? -69.1 169.55 11.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.061 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.543 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -19.75 -67.86 0.01 OUTLIER Glycine 0 C--N 1.335 0.479 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.86 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.422 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 0.7 OUTLIER -130.86 39.0 3.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.049 0.452 . . . . 0.0 110.064 179.223 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.905 HG13 ' O ' ' B' ' 59' ' ' GLY . 93.0 t -152.69 170.18 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.114 -179.385 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.99 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -131.51 162.15 30.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.367 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.99 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -145.61 133.98 16.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.977 0.417 . . . . 0.0 111.489 -179.615 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.997 HD23 ' CG1' ' B' ' 57' ' ' ILE . 4.9 tp -124.15 88.19 2.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.444 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.757 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -95.02 122.33 37.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.246 -179.44 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.838 ' CE2' HG21 ' B' ' 66' ' ' VAL . 0.5 OUTLIER -153.52 120.1 5.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.022 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.856 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -86.22 132.06 34.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.893 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.815 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 2.4 m -94.73 19.53 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.228 0.537 . . . . 0.0 110.956 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 89' ' ' GLY . . . . . 0.471 ' OXT' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.368 -1.24 . . . . 0.0 112.525 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mtt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.759 0.314 . . . . 0.0 111.262 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.613 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -82.5 -134.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.724 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.613 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 1.9 t70 168.85 88.45 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.983 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 1.031 ' HG3' HG11 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -93.87 -41.14 9.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.654 179.814 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.474 ' C ' ' O ' ' A' ' 4' ' ' ARG . 0.5 OUTLIER 30.67 40.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.295 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.095 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -131.07 -171.05 2.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.128 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.451 ' N ' ' O ' ' A' ' 77' ' ' TYR . 25.9 t -145.79 78.69 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.262 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.802 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 1.4 mp -40.03 142.41 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.479 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 3.7 mmpt? -129.83 -12.78 4.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.03 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.57 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 14.4 t30 -154.89 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 1.086 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 76.68 -176.59 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.619 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.777 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 1.0 OUTLIER 162.23 22.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.807 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.923 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 11.0 ttp -114.58 164.59 13.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.687 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . 1.044 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 68.5 m -45.3 135.27 6.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.522 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.473 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.2 mm-40 -41.67 -75.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.071 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -44.68 -22.15 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' MET . . . . . 1.044 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.54 -39.73 31.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.816 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -67.73 -30.1 69.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.589 179.811 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -45.77 19.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -68.18 -29.49 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.484 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.816 ' OG ' HG21 ' A' ' 74' ' ' ILE . 0.2 OUTLIER -66.66 -50.83 61.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.086 179.182 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 1.031 HG11 ' HG3' ' A' ' 4' ' ' ARG . 58.0 t -57.13 -40.36 72.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.343 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.538 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 4.2 mt-10 -63.85 -34.66 78.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.203 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -71.78 -34.06 69.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.764 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.696 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -73.42 -34.15 65.33 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.832 ' HA ' HD12 ' A' ' 29' ' ' LEU . 42.0 m -71.71 -40.19 69.64 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.619 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.823 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -56.17 -43.33 78.28 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.249 178.94 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.943 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -74.93 -22.92 58.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.807 178.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.832 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.9 mt -73.46 -38.38 65.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.945 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.01 -25.21 26.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.768 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -83.92 -35.27 24.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.725 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.654 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -149.92 150.58 32.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.627 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.664 ' HA ' HD11 ' A' ' 38' ' ' ILE . 34.4 t30 -127.51 48.57 2.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.772 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.887 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 40.4 mm -115.45 43.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.701 ' HG2' ' HA ' ' B' ' 62' ' ' PHE . 3.1 mp0 34.56 -87.56 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.596 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.613 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -43.19 -53.75 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.865 0.364 . . . . 0.0 110.456 179.53 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.887 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.4 t70 -45.86 -61.94 1.52 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.588 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.943 HG23 ' HB3' ' A' ' 28' ' ' ALA . 3.7 mt -45.5 -58.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.933 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -49.29 -54.61 16.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.718 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -42.53 -55.24 3.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.111 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.539 ' CE1' ' CD1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.817 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.703 ' CG2' HD11 ' A' ' 85' ' ' LEU . 64.2 mt -47.68 -69.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.218 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.852 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -49.97 -67.08 0.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.987 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.788 ' HD2' ' N ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -33.0 -59.69 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.911 -179.974 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.788 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 5.2 tp10 -54.66 -54.84 36.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.704 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -52.66 -31.65 38.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.942 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.73 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -72.94 -32.15 65.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.872 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mmmm -106.27 4.61 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.372 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.484 ' O ' ' CG ' ' A' ' 50' ' ' TYR . 6.2 tttp -123.98 13.75 9.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.789 0.328 . . . . 0.0 111.101 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.675 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 57.2 m-85 -159.94 -66.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.12 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.488 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 1.3 t30 162.09 115.57 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.726 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.73 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 36.4 Cg_endo -64.98 170.49 10.25 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.433 2.089 . . . . 0.0 112.398 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.68 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.5 t -102.65 128.12 49.47 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 122.86 0.464 . . . . 0.0 110.358 -0.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.836 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 63.6 m95 -94.27 151.44 19.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.407 0.622 . . . . 0.0 111.929 -179.08 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.826 ' HB2' ' CE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -136.67 94.19 2.96 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.954 179.257 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.995 ' HB2' HD12 ' A' ' 85' ' ' LEU . 8.8 p -115.97 154.9 29.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.349 0.595 . . . . 0.0 112.422 -178.122 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.994 HD12 ' HA ' ' B' ' 64' ' ' SER . 16.3 mm -126.96 174.71 10.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.001 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.933 HG12 ' HB2' ' A' ' 39' ' ' ALA . 8.1 p -170.88 110.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.961 0.41 . . . . 0.0 111.76 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.686 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.39 -135.83 2.15 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.765 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.447 ' H ' ' H ' ' A' ' 61' ' ' ASN . 4.5 ptt180 -173.69 -9.85 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.447 ' H ' ' H ' ' A' ' 60' ' ' ARG . 16.3 p30 -148.72 44.83 1.02 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.087 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.849 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -120.19 165.73 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.93 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.854 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -112.77 86.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.792 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.952 ' HA ' HG23 ' B' ' 57' ' ' ILE . 2.9 p -81.91 118.56 23.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.045 0.45 . . . . 0.0 111.58 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.984 ' H ' HD13 ' B' ' 57' ' ' ILE . 7.4 t80 -132.37 76.68 1.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.006 HG13 HD11 ' B' ' 57' ' ' ILE . 5.5 m -127.55 140.44 49.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.824 HG21 HG21 ' B' ' 53' ' ' THR . 3.3 t -95.69 120.52 36.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.435 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -60.95 -164.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.876 -179.89 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.521 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 1.0 OUTLIER -127.11 -46.84 1.5 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.346 -179.752 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.504 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 28.3 m -157.92 -42.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.481 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.777 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 7.7 mtpt -164.7 -159.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.758 0.313 . . . . 0.0 110.882 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 1.044 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 0.0 OUTLIER 56.17 18.82 3.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.011 0.434 . . . . 0.0 110.436 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.829 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 7.0 t80 -116.15 101.61 8.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.498 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 1.086 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -121.4 118.25 55.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.316 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -115.21 94.6 4.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.763 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.819 ' CZ ' ' HA ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -114.7 -178.88 3.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.164 -179.778 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.688 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 16.1 t80 -140.31 102.69 4.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.095 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -59.64 173.05 0.6 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.273 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.96 -44.86 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.936 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.418 ' N ' ' O ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -148.21 26.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.22 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.754 HG11 HD21 ' A' ' 29' ' ' LEU . 72.2 t -139.65 168.3 18.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.989 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.723 ' O ' ' HA ' ' A' ' 58' ' ' VAL . . . -136.63 125.88 24.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.594 HG21 ' CB ' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -113.23 119.99 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.993 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.981 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 21.4 tp -100.78 80.45 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.18 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.995 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -86.32 137.78 32.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.072 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.829 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -174.23 127.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.563 179.635 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 1.044 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -90.14 -169.75 2.53 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.925 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.521 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -122.78 19.73 10.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.308 0.575 . . . . 0.0 110.81 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.086 0 CA-C-O 118.413 -1.215 . . . . 0.0 112.499 -179.99 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.482 ' O ' ' HB3' ' B' ' 2' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.77 0.319 . . . . 0.0 111.129 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.612 ' SG ' ' N ' ' B' ' 3' ' ' ASP . 0.0 OUTLIER 70.09 -77.92 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.781 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.612 ' N ' ' SG ' ' B' ' 2' ' ' CYS . 0.4 OUTLIER -139.65 36.45 2.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.88 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.42 ' O ' ' CB ' ' B' ' 5' ' ' LYS . 0.1 OUTLIER -104.81 -89.34 0.42 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.684 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.632 ' HG2' ' H ' ' B' ' 6' ' ' ALA . 22.8 tttt 76.62 -152.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.724 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.075 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 52.74 175.85 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.183 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.748 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 59.0 t -147.83 71.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.727 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.793 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -34.8 140.32 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.521 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.748 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 3.2 mmtp -115.27 -25.58 7.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.213 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -140.83 -87.97 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.165 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 1.066 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 62.64 106.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.095 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -109.28 24.32 13.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.648 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.761 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -107.82 173.31 6.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.761 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.2 OUTLIER -54.61 128.0 30.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.856 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.613 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 1.7 mm-40 -39.85 -64.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -50.36 -27.45 6.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.548 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.647 ' HB2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -75.55 -31.61 60.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.701 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 1.054 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.5 OUTLIER -71.29 -36.2 71.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.395 179.65 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.556 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 67.9 mt-30 -74.82 -35.57 62.44 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.88 -34.91 62.29 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.856 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 1.4 t -65.19 -42.49 93.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.756 179.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.964 HG22 ' CD2' ' B' ' 76' ' ' PHE . 91.2 t -60.94 -50.0 82.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.332 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.556 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 20.7 mt-10 -53.75 -38.61 64.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.297 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.598 ' SG ' ' CE1' ' B' ' 46' ' ' PHE . 71.9 m -65.71 -38.46 89.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.011 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.805 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -68.77 -30.2 68.75 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.412 ' H ' ' HG1' ' B' ' 26' ' ' THR . 0.7 OUTLIER -72.43 -40.2 67.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.361 -1.291 . . . . 0.0 109.926 178.787 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.857 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -56.86 -43.77 81.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.892 179.354 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 1.061 ' HB3' HG23 ' B' ' 38' ' ' ILE . . . -73.51 -34.29 65.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.423 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.805 HD12 ' O ' ' B' ' 25' ' ' ALA . 2.3 mt -65.53 -40.82 93.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.876 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.96 -18.52 34.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 1.1 mmmm -83.38 -21.14 33.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.822 ' CB ' HD13 ' B' ' 34' ' ' ILE . 0.1 OUTLIER -153.01 -49.0 0.1 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.792 -179.921 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.611 ' C ' HD12 ' B' ' 34' ' ' ILE . 0.2 OUTLIER 83.37 28.42 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.777 -179.561 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.822 HD13 ' CB ' ' B' ' 32' ' ' TYR . 1.1 mp -111.2 140.76 29.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.736 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.854 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -53.91 -70.91 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.897 0.379 . . . . 0.0 110.62 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.527 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -54.18 -55.86 23.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.609 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 12.3 t0 -47.4 -60.74 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.723 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 1.061 HG23 ' HB3' ' B' ' 28' ' ' ALA . 26.6 mt -46.88 -60.66 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.982 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.764 ' CB ' ' HB2' ' A' ' 65' ' ' TYR . . . -40.94 -46.1 2.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 0.0 110.562 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.819 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -63.08 -62.93 1.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.406 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.857 ' NE2' ' HB3' ' B' ' 27' ' ' GLN . 0.8 OUTLIER -39.23 -42.3 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.59 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.783 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 7.9 mt -72.47 -70.14 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.256 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.831 ' NZ ' HG23 ' B' ' 53' ' ' THR . 27.9 tttp -36.97 -48.02 0.74 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.642 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 6.5 mttt -62.39 -56.03 22.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.261 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.777 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -57.01 -58.32 8.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.831 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.856 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -40.57 -64.24 0.55 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.958 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.789 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 2.8 p30 -46.4 -42.41 15.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.844 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.777 ' HG3' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -69.93 -36.87 75.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.865 -179.379 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.466 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.35 -9.66 46.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.693 -179.212 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.753 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 92.8 m-85 -127.5 -70.05 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.454 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.753 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 5.7 t-20 161.06 109.45 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.035 -179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.789 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 96.8 Cg_exo -43.53 154.65 0.2 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 122.344 2.029 . . . . 0.0 112.479 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.831 HG23 ' NZ ' ' B' ' 43' ' ' LYS . 6.1 m -119.2 134.62 55.11 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 122.927 0.491 . . . . 0.0 110.652 0.017 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.789 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 45.0 m95 -100.12 125.71 46.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.055 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.727 ' HB2' ' O ' ' B' ' 86' ' ' PHE . 62.8 m170 -93.77 94.76 8.72 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.726 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.7 OUTLIER -102.52 151.39 22.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -177.37 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 1.06 HG13 HD23 ' B' ' 84' ' ' LEU . 13.7 mm -139.83 155.82 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.386 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 0.816 HG23 HG11 ' B' ' 81' ' ' VAL . 1.5 p -162.11 109.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 111.59 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.841 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -136.23 -123.28 2.26 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.832 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 60' ' ' ARG . 0.8 OUTLIER -166.09 -23.88 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.57 0.224 . . . . 0.0 111.523 179.907 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.607 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 1.5 m-20 -157.61 46.25 0.37 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.824 0.345 . . . . 0.0 111.282 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.849 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.2 p90 -102.88 175.08 5.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.938 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.79 87.43 0.41 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.375 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.994 ' HA ' HD12 ' A' ' 57' ' ' ILE . 10.9 p -85.21 121.64 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.958 0.409 . . . . 0.0 111.105 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.852 ' HE2' ' HD2' ' A' ' 43' ' ' LYS . 11.6 t80 -134.18 61.33 1.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.629 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.942 HG13 HD11 ' A' ' 57' ' ' ILE . 17.5 m -96.7 164.65 2.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.16 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.671 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 93.5 m -101.7 98.93 9.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.861 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -43.36 169.85 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.717 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.8 OUTLIER -142.13 -119.78 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.99 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.568 ' C ' ' H ' ' B' ' 72' ' ' HIS . 41.5 p -39.4 -98.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.014 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' B' ' 13' ' ' MET . 3.4 mmmm -68.74 18.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.77 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.861 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 20.1 m170 65.78 -88.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.765 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 2.4 p90 165.74 -176.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.0 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 1.066 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -156.67 114.63 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.545 179.305 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.811 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 1.3 t80 -100.4 137.71 38.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.918 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.964 ' CD2' HG22 ' B' ' 22' ' ' VAL . 1.0 OUTLIER -162.62 156.83 21.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.824 0.345 . . . . 0.0 111.376 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 2.1 t80 -116.89 112.61 21.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.292 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.075 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.1 mm? -69.92 170.31 11.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.639 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.5 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -28.5 -36.29 0.01 OUTLIER Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.497 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.615 ' O ' HG23 ' B' ' 81' ' ' VAL . 2.5 mt-30 -158.62 44.35 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.921 0.391 . . . . 0.0 110.694 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.841 HG13 ' O ' ' B' ' 59' ' ' GLY . 37.7 t -160.02 169.36 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.036 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.606 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -135.88 111.13 9.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.344 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.781 ' HB ' ' CZ ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -98.64 133.61 40.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.157 0.503 . . . . 0.0 112.012 -179.191 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 1.06 HD23 HG13 ' B' ' 57' ' ' ILE . 0.4 OUTLIER -118.85 94.39 4.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.768 179.423 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.765 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 0.5 OUTLIER -98.24 135.7 39.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -179.031 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.727 ' O ' ' HB2' ' B' ' 55' ' ' HIS . 9.3 p90 -174.43 121.03 0.26 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.84 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.789 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -90.49 161.51 15.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 110.923 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.717 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -117.76 21.23 13.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.338 0.59 . . . . 0.0 110.486 179.774 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.151 0 CA-C-O 118.325 -1.264 . . . . 0.0 112.504 -179.806 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 ptt? . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.872 0.368 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.4 t 75.61 -56.92 0.59 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.896 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.47 -174.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.87 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.43 ' CD ' ' N ' ' A' ' 4' ' ' ARG . 1.0 OUTLIER -67.85 -73.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.087 -179.828 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt 68.76 -163.27 0.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.965 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.975 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.41 153.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.75 HG12 ' HE2' ' A' ' 9' ' ' LYS . 92.4 t -118.66 71.12 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.834 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.877 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -35.63 137.02 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.75 ' HE2' HG12 ' A' ' 7' ' ' VAL . 12.0 mmtt -125.82 -11.26 6.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.647 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.56 ' O ' ' HE1' ' A' ' 73' ' ' PHE . 6.7 t-20 -168.52 87.12 0.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.799 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.668 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -121.91 109.42 14.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.911 0.386 . . . . 0.0 111.685 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.64 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 2.7 m-20 -112.23 30.66 6.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.123 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.681 ' HG3' ' H ' ' A' ' 14' ' ' SER . 11.3 ttp -117.89 171.05 8.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.761 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.729 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 m -53.55 134.62 40.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.028 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.655 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 tm-20 -45.99 -68.27 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.93 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -44.49 -27.33 0.44 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.831 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.645 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.79 -50.03 16.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.541 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.973 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -58.72 -26.83 64.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.481 179.738 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 3.4 pt20 -77.85 -45.29 24.74 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.441 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 36.5 m-20 -67.4 -26.53 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.563 178.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.946 ' OG ' HD22 ' A' ' 85' ' ' LEU . 28.8 t -68.0 -52.57 34.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.612 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.837 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 47.5 t -54.5 -47.7 70.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.48 -35.81 72.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.95 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.923 ' SG ' HG23 ' A' ' 42' ' ' ILE . 10.2 t -67.29 -35.4 79.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.986 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.748 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -72.86 -33.99 66.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.603 ' HA ' HD12 ' A' ' 29' ' ' LEU . 2.4 m -69.62 -37.32 76.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.523 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 2.7 mt-30 -61.78 -41.73 98.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.855 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.77 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -79.5 -17.4 54.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.138 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.658 HD12 ' C ' ' A' ' 25' ' ' ALA . 5.5 mt -80.97 -37.01 30.05 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.971 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.21 -26.96 23.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.249 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.523 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -85.07 -23.6 28.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.951 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.601 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -144.29 -161.2 1.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.644 ' C ' HD13 ' A' ' 34' ' ' ILE . 0.3 OUTLIER -166.32 28.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.613 179.86 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.042 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.4 mm -118.39 103.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.665 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.669 ' HA ' HD12 ' A' ' 38' ' ' ILE . 1.0 OUTLIER -26.33 -77.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.012 0.434 . . . . 0.0 110.821 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.529 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -40.36 -42.15 1.51 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.905 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 1.042 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -64.89 -58.75 5.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.913 ' HB ' HG11 ' A' ' 58' ' ' VAL . 3.8 mt -46.82 -48.42 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.997 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.56 -38.86 82.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.867 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.801 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -59.85 -67.71 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.015 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.674 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -50.39 -49.96 52.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.824 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.923 HG23 ' SG ' ' A' ' 24' ' ' CYS . 98.2 mt -49.99 -67.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.167 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.807 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 4.5 tmtt? -51.25 -40.75 59.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.582 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 1.1 tppt? -54.39 -57.37 11.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.015 0.436 . . . . 0.0 110.736 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 49' ' ' LYS . 5.3 mt-10 -54.0 -54.57 37.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.644 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.789 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.7 m-85 -52.23 -46.75 65.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.867 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.807 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.81 -12.54 61.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.292 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.423 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -123.66 13.21 9.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.739 0.304 . . . . 0.0 111.259 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' A' ' 45' ' ' GLU . 6.0 ttmm -129.96 -31.61 1.92 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.189 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.682 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 60.0 m-85 -109.82 -57.23 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.074 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.78 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 1.5 t-20 160.83 114.22 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.433 -179.789 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.714 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 16.5 Cg_endo -57.16 165.92 4.82 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.355 2.037 . . . . 0.0 112.455 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.717 HG21 HG21 ' B' ' 67' ' ' THR . 1.2 m -108.66 124.89 51.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 122.974 0.509 . . . . 0.0 110.361 -0.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.75 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.5 m95 -96.89 160.84 14.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.607 . . . . 0.0 111.996 -179.329 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.823 ' HD2' ' HA ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -152.43 111.98 3.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.079 179.352 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.926 ' HB2' HD12 ' A' ' 85' ' ' LEU . 13.7 p -120.3 151.61 38.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.033 HD11 HG13 ' B' ' 66' ' ' VAL . 20.8 mm -126.03 118.36 51.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.444 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.997 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.4 p -113.04 124.03 69.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.6 ' O ' ' HB3' ' A' ' 82' ' ' ALA . . . -157.9 173.84 35.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.275 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.5 OUTLIER -137.7 40.05 2.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.678 0.275 . . . . 0.0 111.295 -179.632 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER 167.89 28.8 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.919 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.878 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 15.7 p90 -117.0 -172.32 2.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.163 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.811 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.63 102.49 0.27 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.737 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.967 ' CB ' HD12 ' B' ' 57' ' ' ILE . 63.6 p -84.87 138.22 32.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.063 0.459 . . . . 0.0 111.731 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.823 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 54.8 t80 -153.32 89.63 1.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.034 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.743 HG12 ' N ' ' B' ' 56' ' ' CYS . 6.2 m -135.18 -161.44 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.203 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.869 ' HB ' HG21 ' B' ' 53' ' ' THR . 0.7 OUTLIER -99.88 -161.16 0.85 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.794 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.713 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 20.8 p80 -168.42 122.53 0.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.804 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.545 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -130.83 157.89 41.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.511 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 74.94 -85.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.047 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.538 ' O ' ' HB2' ' A' ' 13' ' ' MET . 28.7 mttt -109.96 14.44 23.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.713 ' O ' ' HB2' ' A' ' 68' ' ' HIS . 6.7 m170 71.64 -86.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.752 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.694 ' HB3' ' HB2' ' A' ' 86' ' ' PHE . 1.8 p90 162.3 -167.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.436 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.973 HG13 ' HB3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -165.39 110.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.994 0.426 . . . . 0.0 111.673 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.749 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -100.39 138.06 37.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.079 179.198 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.972 ' CE1' HD13 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -159.22 132.97 7.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.979 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' A' ' 81' ' ' VAL . 18.7 t80 -98.95 102.37 14.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.798 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.975 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.2 mm? -55.82 170.02 0.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.763 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.89 -33.25 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.661 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.572 ' N ' ' O ' ' A' ' 78' ' ' LEU . 0.4 OUTLIER -160.08 39.84 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 111.094 -179.812 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.616 HG12 ' N ' ' A' ' 82' ' ' ALA . 81.3 t -156.95 165.31 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.746 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.662 ' C ' HD13 ' A' ' 83' ' ' ILE . . . -125.82 140.97 52.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.553 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.662 HD13 ' C ' ' A' ' 82' ' ' ALA . 0.0 OUTLIER -134.18 130.73 54.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.979 0.418 . . . . 0.0 111.446 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.814 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -120.35 97.7 5.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.851 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.946 HD22 ' OG ' ' A' ' 21' ' ' SER . 1.4 mp -99.65 124.34 44.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.61 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.694 ' HB2' ' HB3' ' A' ' 73' ' ' PHE . 3.0 p90 -166.04 140.79 4.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.29 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.823 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 15.8 mtpt -90.24 -147.18 0.19 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.593 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.674 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -166.21 18.96 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.386 0.612 . . . . 0.0 110.473 179.681 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.414 -1.214 . . . . 0.0 112.552 179.954 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.716 ' HG2' ' O ' ' B' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.872 0.368 . . . . 0.0 111.184 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' B' ' 3' ' ' ASP . 0.0 OUTLIER -164.17 150.3 11.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.86 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' B' ' 3' ' ' ASP . 0.4 OUTLIER 164.64 -161.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.908 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.59 ' O ' ' HB3' ' B' ' 5' ' ' LYS . 1.9 tpp85 30.94 -104.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.056 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.59 ' HB3' ' O ' ' B' ' 4' ' ' ARG . 0.7 OUTLIER 79.32 31.04 0.29 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.667 -179.757 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.46 -165.94 1.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.454 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.576 ' N ' ' O ' ' B' ' 77' ' ' TYR . 87.7 t -154.08 75.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.195 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.789 HD12 ' HB3' ' B' ' 76' ' ' PHE . 1.3 mp -34.69 140.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.266 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.475 ' HE3' ' HB3' ' B' ' 77' ' ' TYR . 7.0 mmtp -119.55 -11.32 9.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.769 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.636 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 51.4 t30 -168.7 -94.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.392 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.896 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 80.41 -179.67 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.598 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.4 m-20 177.15 35.26 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.694 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.808 ' H ' ' NE2' ' B' ' 18' ' ' GLN . 19.6 ttp -130.87 167.66 18.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.838 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.591 ' O ' ' HB2' ' B' ' 17' ' ' MET . 0.0 OUTLIER -48.63 131.3 17.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.91 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.474 ' CA ' ' HG2' ' B' ' 18' ' ' GLN . 1.7 mp0 -40.99 -64.92 0.48 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.671 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 1.1 mm-40 -46.32 -35.96 5.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.305 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.779 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 43.9 mmm -68.34 -33.72 74.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.049 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 1.015 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.7 OUTLIER -73.54 -33.74 64.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.137 179.232 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.739 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 13.1 pt20 -78.0 -36.36 48.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.582 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.664 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER -76.53 -31.64 57.76 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.323 178.623 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -67.88 -49.13 63.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.861 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.949 HG23 ' O ' ' B' ' 18' ' ' GLN . 48.6 t -59.47 -42.94 89.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.228 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.739 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 2.2 mt-10 -60.71 -34.33 74.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.079 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 47.1 m -68.85 -38.5 79.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.118 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.799 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -68.98 -28.23 66.43 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.565 ' HA ' HD12 ' B' ' 29' ' ' LEU . 4.2 m -72.05 -37.74 69.63 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.64 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.743 ' O ' ' HD3' ' B' ' 31' ' ' LYS . 44.2 mt-30 -59.14 -45.71 90.24 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.454 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.93 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -75.81 -20.37 58.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.486 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.839 ' CD2' HG21 ' B' ' 81' ' ' VAL . 4.8 mt -76.42 -45.1 33.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.054 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.29 -23.74 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.992 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.743 ' HD3' ' O ' ' B' ' 27' ' ' GLN . 1.3 mttp -84.93 -33.52 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.731 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.632 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -141.03 -175.94 4.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.63 179.857 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -145.97 34.82 1.01 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.892 0.377 . . . . 0.0 110.842 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 1.014 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.5 mm -120.23 103.82 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.084 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.811 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -29.57 -64.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 110.698 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.5 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 11.9 mmmt -50.86 -54.75 21.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.076 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 1.014 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.4 m-20 -54.69 -61.62 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.567 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.93 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 9.9 mt -41.15 -45.64 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.757 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 1.037 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -64.83 -45.59 85.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.721 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.823 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -54.35 -57.09 12.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.949 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.766 ' CE1' ' HB3' ' B' ' 37' ' ' ASP . 0.1 OUTLIER -54.55 -40.47 68.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.97 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.73 HG13 ' O ' ' B' ' 38' ' ' ILE . 49.1 mt -64.5 -68.89 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.67 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -40.56 -43.04 1.8 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.79 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.615 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 3.9 mtpp -62.56 -54.31 41.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 10.4 mt-10 -64.69 -25.1 67.8 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.075 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -76.96 -46.41 24.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.921 0.391 . . . . 0.0 110.882 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.787 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.3 p30 -66.76 -24.68 66.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.477 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.447 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -89.94 -42.34 11.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.057 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -80.27 -14.56 58.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.36 -179.584 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.664 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 43.5 m-85 -131.11 -71.16 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.665 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 0.5 OUTLIER 157.39 118.9 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.787 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 26.6 Cg_endo -61.52 170.14 5.87 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.512 2.141 . . . . 0.0 112.347 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.869 HG21 ' HB ' ' A' ' 67' ' ' THR . 1.9 m -101.91 136.83 41.07 Favored 'General case' 0 C--N 1.343 0.287 0 C-N-CA 123.044 0.538 . . . . 0.0 110.612 0.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.783 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 56.4 m95 -107.92 105.45 15.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.505 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.792 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 5.9 m170 -78.25 93.83 4.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.987 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.3 OUTLIER -108.5 140.62 41.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.357 0.599 . . . . 0.0 112.589 -178.017 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.987 HD13 ' O ' ' B' ' 56' ' ' CYS . 19.1 mm -135.56 103.45 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.913 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.037 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -103.52 125.41 58.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.678 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.745 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.2 -110.62 0.73 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.959 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.685 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 6.9 ptt180 168.74 3.57 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 178.8 29.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.683 0.277 . . . . 0.0 111.461 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.875 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 2.9 p90 -92.96 -167.34 1.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.055 0.455 . . . . 0.0 110.832 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -139.94 86.11 0.21 Allowed Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.833 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.895 ' CA ' HD12 ' A' ' 57' ' ' ILE . 5.8 p -82.33 122.51 28.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.065 0.46 . . . . 0.0 111.32 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.801 ' CD1' ' HA ' ' A' ' 40' ' ' ALA . 46.6 t80 -133.44 83.53 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.426 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 1.033 HG13 HD11 ' A' ' 57' ' ' ILE . 7.5 m -118.85 150.34 21.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.717 HG21 HG21 ' A' ' 53' ' ' THR . 18.4 m -73.18 77.87 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.603 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.465 ' HB2' ' CB ' ' B' ' 73' ' ' PHE . 29.4 p-80 -59.59 169.01 1.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.821 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 178.11 173.54 0.61 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.489 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 1.6 m 75.81 -89.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.789 ' HE2' ' CE1' ' B' ' 72' ' ' HIS . 0.5 OUTLIER 166.53 43.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.789 ' CE1' ' HE2' ' B' ' 71' ' ' LYS . 84.9 m-70 -138.85 31.25 2.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.794 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 7.6 t80 -111.8 79.36 1.21 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.566 179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 1.015 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -102.87 123.88 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.173 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.71 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -111.91 137.02 50.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.344 179.645 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.805 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 8.0 p90 -161.18 168.33 24.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.982 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.652 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 47.1 t80 -133.92 115.49 14.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.96 170.1 11.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.619 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.502 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.09 -48.07 0.05 OUTLIER Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.733 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.453 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -146.45 38.78 1.05 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.877 0.37 . . . . 0.0 110.747 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.839 HG21 ' CD2' ' B' ' 29' ' ' LEU . 76.5 t -152.25 167.67 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.961 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.738 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -134.32 143.18 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.701 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.799 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.3 OUTLIER -135.5 128.9 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.996 0.427 . . . . 0.0 111.212 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.779 ' O ' ' HA ' ' B' ' 56' ' ' CYS . 0.1 OUTLIER -121.15 96.83 5.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.521 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.967 HD12 ' HB3' ' B' ' 56' ' ' CYS . 1.8 mp -100.09 117.86 35.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.953 ' CE2' HG21 ' B' ' 66' ' ' VAL . 1.0 OUTLIER -150.99 126.59 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.923 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.783 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.6 OUTLIER -103.7 152.76 21.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.82 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.792 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -111.16 17.64 20.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.255 0.55 . . . . 0.0 110.628 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 89' ' ' GLY . . . . . 0.471 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.093 0 CA-C-O 118.419 -1.212 . . . . 0.0 112.622 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.575 ' SD ' ' N ' ' A' ' 2' ' ' CYS . 5.4 tpp . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.836 0.35 . . . . 0.0 111.151 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.575 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.5 OUTLIER 43.09 -171.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.863 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.406 ' HB3' ' H ' ' A' ' 4' ' ' ARG . 7.5 m-20 -112.48 -136.63 0.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.004 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.643 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.4 OUTLIER 74.49 -66.82 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.98 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.04 -168.31 0.2 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.817 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.62 166.6 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.646 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 7' ' ' VAL . 65.2 t -134.52 71.51 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.767 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.865 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -31.86 152.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.947 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.585 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -142.81 -11.63 0.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.501 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.47 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER 179.63 103.88 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.53 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.674 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -140.02 130.03 24.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.561 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.616 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 27.4 m-20 -121.17 24.15 10.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.304 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.673 ' HG3' ' H ' ' A' ' 14' ' ' SER . 17.0 ttp -104.01 170.47 7.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.794 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.703 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 0.3 OUTLIER -46.82 138.86 5.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.9 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.615 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 24.9 mp0 -50.26 -64.78 0.7 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 6.4 tt0 -58.21 -16.72 14.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.974 0.416 . . . . 0.0 110.097 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.703 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -81.75 -39.15 24.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.669 179.61 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.992 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.16 -37.94 84.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.521 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.643 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 2.6 mt-30 -75.21 -36.29 61.41 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.532 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 2.1 m-20 -69.5 -35.11 75.23 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.549 178.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.802 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 1.2 t -64.22 -45.37 88.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.728 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.659 HG13 ' HB2' ' A' ' 6' ' ' ALA . 69.5 t -55.97 -51.13 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.327 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -56.93 -34.18 67.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.588 ' HB3' HG23 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -68.88 -34.35 75.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.694 179.131 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.822 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -72.33 -38.39 68.65 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.504 ' HA ' HD12 ' A' ' 29' ' ' LEU . 34.2 m -67.3 -38.06 84.4 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.711 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.786 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -58.65 -44.31 90.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.512 178.916 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.863 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -72.57 -26.69 61.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.698 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.822 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.6 mt -74.19 -35.82 63.99 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.851 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.94 -28.82 49.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.399 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.786 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 25.5 mmtt -85.2 -33.71 22.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.209 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.589 ' CE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.4 140.8 16.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.503 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -104.75 29.95 5.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.742 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 39.7 mm -104.92 110.22 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.063 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.56 ' HA ' HD12 ' A' ' 38' ' ' ILE . 7.3 mp0 -27.5 -85.83 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.025 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.488 ' HG3' HG22 ' A' ' 34' ' ' ILE . 2.0 pttt -39.13 -34.45 0.17 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.904 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.742 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 49.2 t0 -66.37 -50.88 62.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.069 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.95 HG22 HD11 ' A' ' 42' ' ' ILE . 5.7 mt -58.84 -43.68 88.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 1.012 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -60.23 -39.58 87.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.705 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.797 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -65.55 -63.29 1.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.863 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -42.77 -62.54 0.98 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.478 179.531 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.95 HD11 HG22 ' A' ' 38' ' ' ILE . 16.4 mt -45.42 -66.15 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.356 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.658 ' HB3' ' CE2' ' B' ' 65' ' ' TYR . 0.6 OUTLIER -42.25 -66.23 0.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.938 -179.813 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.537 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 5.0 tptp -36.61 -54.09 0.88 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.672 ' OE1' ' HA ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -57.88 -68.82 0.21 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.728 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.802 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.3 m-85 -37.63 -53.31 1.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.94 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.691 ' OD1' ' HG3' ' A' ' 52' ' ' PRO . 4.5 t70 -54.97 -37.32 66.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.868 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -104.88 11.96 33.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 179.85 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 2.8 mmmt -131.12 11.58 5.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.279 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.611 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 77.8 m-85 -157.58 -63.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.63 0.253 . . . . 0.0 111.487 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 2.5 t30 164.17 107.87 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.58 -179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.691 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 82.5 Cg_exo -47.27 152.23 2.32 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.37 2.046 . . . . 0.0 112.43 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . 1.014 HG21 HG21 ' B' ' 67' ' ' THR . 91.0 m -117.88 133.31 56.05 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 123.08 0.552 . . . . 0.0 110.557 -0.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.837 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.5 m95 -97.44 143.93 27.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.173 0.511 . . . . 0.0 111.784 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.757 ' HB3' ' CB ' ' B' ' 66' ' ' VAL . 1.4 m-70 -131.93 112.76 12.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.278 179.08 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.975 ' HB2' HD12 ' A' ' 85' ' ' LEU . 4.4 p -124.84 154.35 41.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.37 0.605 . . . . 0.0 112.596 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.113 HG21 HG21 ' B' ' 57' ' ' ILE . 12.3 mm -131.15 113.22 23.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.234 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.012 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.5 p -105.02 128.99 58.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.019 0.437 . . . . 0.0 111.184 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.736 ' HA3' ' CD1' ' A' ' 62' ' ' PHE . . . -157.99 170.13 34.8 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.995 -0.621 . . . . 0.0 111.783 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.536 ' HB3' ' HA ' ' A' ' 81' ' ' VAL . 0.0 OUTLIER -132.84 34.82 3.6 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.956 0.408 . . . . 0.0 110.887 -179.792 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 1.1 t-20 169.63 27.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.68 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.982 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 20.7 p90 -115.52 -169.83 1.65 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.906 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.35 95.6 0.17 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.916 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.976 ' CB ' HD12 ' B' ' 57' ' ' ILE . 20.0 p -80.99 140.5 35.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.979 0.419 . . . . 0.0 111.539 -179.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.825 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 71.8 t80 -149.13 93.23 2.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.283 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.947 HG21 ' CD2' ' A' ' 86' ' ' PHE . 4.1 m -133.1 149.35 31.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.702 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.929 HG21 HG21 ' B' ' 53' ' ' THR . 1.6 t -79.58 147.31 32.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.679 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 1.044 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -100.92 155.03 18.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.22 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.664 ' HG3' ' OG ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -129.65 -82.48 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.045 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.551 ' C ' ' H ' ' A' ' 72' ' ' HIS . 36.2 m -66.0 -107.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.941 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.586 ' HG3' ' HG3' ' A' ' 13' ' ' MET . 0.0 OUTLIER -69.87 31.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.9 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 1.044 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 1.1 m80 56.61 -91.36 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.636 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.78 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 161.59 -174.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.718 179.756 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.992 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -154.92 131.76 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.265 -179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.538 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 2.3 t80 -120.61 133.39 55.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.071 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.865 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -151.66 164.73 36.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.94 0.4 . . . . 0.0 111.113 -179.516 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.601 ' O ' ' HD1' ' A' ' 77' ' ' TYR . 4.0 t80 -122.92 92.53 3.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.964 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.8 mm? -48.12 166.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.692 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -24.47 -54.93 0.05 OUTLIER Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.99 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.72 12.15 3.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.693 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.843 HG12 ' H ' ' A' ' 82' ' ' ALA . 21.8 t -129.58 179.64 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.502 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.843 ' H ' HG12 ' A' ' 81' ' ' VAL . . . -141.19 143.51 34.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.726 0.298 . . . . 0.0 110.67 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.783 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -130.96 125.78 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.739 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.91 HD23 HG12 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -113.12 96.98 6.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.115 179.51 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.975 HD12 ' HB2' ' A' ' 56' ' ' CYS . 1.7 mp -95.6 128.89 42.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.892 0.377 . . . . 0.0 111.494 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.947 ' CD2' HG21 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -159.84 119.67 2.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.989 179.493 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.837 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -111.69 149.67 31.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.047 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.664 ' OG ' ' HG3' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -111.44 18.59 19.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.326 0.584 . . . . 0.0 110.587 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.376 -1.236 . . . . 0.0 112.485 -179.958 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.839 0.352 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -153.11 166.85 31.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 56.17 86.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.06 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.407 ' HD3' HH11 ' B' ' 4' ' ' ARG . 0.0 OUTLIER -178.84 4.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.038 179.866 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.642 ' O ' ' HB2' ' B' ' 6' ' ' ALA . 0.0 OUTLIER -47.74 118.51 2.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.763 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.936 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.67 -179.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.765 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.705 HG23 ' O ' ' B' ' 77' ' ' TYR . 41.2 t -145.06 63.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.921 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.5 OUTLIER -33.49 148.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.442 -179.845 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.588 ' HG2' ' O ' ' B' ' 8' ' ' ILE . 13.9 mmtt -148.21 -1.86 0.54 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.929 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.483 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 10.3 t-20 -175.22 83.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.761 179.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.752 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -123.7 113.51 18.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.831 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.901 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 94.7 m-20 -110.65 37.7 2.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.984 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 17' ' ' MET . 17.3 ttp -125.68 170.97 11.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.075 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.712 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.44 141.84 14.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.827 179.877 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.661 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 17.7 mp0 -50.89 -60.53 2.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.896 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 1.3 mt-10 -54.24 -20.73 7.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.536 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -82.67 -34.57 27.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.866 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 1.036 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.69 -36.97 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.823 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.763 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 10.4 mp0 -77.06 -40.72 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.519 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 5.0 m-20 -67.05 -34.01 76.77 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.468 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.853 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -65.5 -46.65 78.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.034 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.845 HG22 ' CD2' ' B' ' 76' ' ' PHE . 73.3 t -56.28 -42.38 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.242 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.763 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 24.1 mt-10 -60.6 -39.4 87.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.333 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.539 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 4.1 t -66.51 -32.97 74.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 110.097 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.78 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -73.22 -32.15 64.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.977 ' HA ' HD12 ' B' ' 29' ' ' LEU . 90.1 m -72.43 -39.53 67.78 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.312 -1.313 . . . . 0.0 109.639 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.789 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 80.7 mm-40 -58.11 -46.1 86.13 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.315 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.997 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -67.93 -29.09 68.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.843 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.988 HD11 ' HG ' ' B' ' 78' ' ' LEU . 4.5 mt -65.36 -57.11 9.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.664 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -34.48 71.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.803 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.789 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 16.0 mmtt -79.83 -28.78 40.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.676 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.552 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -167.56 133.63 2.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.183 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 5.2 p-10 -97.47 26.25 5.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.564 179.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 1.019 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 10.3 mm -95.84 109.98 23.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.743 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.906 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 0.5 OUTLIER -29.73 -70.37 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.116 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.616 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -50.67 -56.52 11.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.916 0.388 . . . . 0.0 110.557 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 1.019 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -43.99 -64.17 0.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.541 179.806 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.997 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 7.0 mt -45.49 -52.96 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.671 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.911 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -51.4 -39.16 56.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.825 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -66.89 -63.38 1.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.573 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.672 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.5 OUTLIER -42.84 -47.34 5.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.518 179.672 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.78 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 32.5 mt -61.74 -70.44 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.393 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.766 ' HB3' ' CE2' ' A' ' 65' ' ' TYR . 0.5 OUTLIER -36.49 -58.98 0.68 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.478 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 1.6 tttm -51.38 -42.28 61.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.54 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.771 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -70.45 -42.25 71.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.358 -179.458 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.853 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -63.56 -35.78 81.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.014 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.801 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -68.84 -46.43 68.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.698 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.4 ' N ' ' CG ' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -78.16 -25.49 47.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.219 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.771 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -89.7 -16.9 29.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.122 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.749 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 53.6 m-85 -125.93 -72.01 0.67 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.455 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.749 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 52.7 t30 160.09 108.55 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.801 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 62.4 Cg_exo -35.02 157.23 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.562 2.174 . . . . 0.0 112.63 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.929 HG21 HG21 ' A' ' 67' ' ' THR . 0.3 OUTLIER -121.92 120.13 33.56 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 122.809 0.444 . . . . 0.0 110.611 -0.005 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.836 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 33.8 m95 -88.69 155.29 19.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.278 0.561 . . . . 0.0 111.491 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.781 ' CD2' ' CZ ' ' A' ' 86' ' ' PHE . 1.6 m80 -136.03 99.11 4.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.265 -0.88 . . . . 0.0 108.888 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.998 ' O ' HD13 ' B' ' 57' ' ' ILE . 2.3 m -108.08 151.51 25.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 1.113 HG21 HG21 ' A' ' 57' ' ' ILE . 18.1 mm -135.46 108.15 8.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.629 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 0.911 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.1 p -111.1 125.78 68.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -178.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.894 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -146.63 -96.1 0.18 Allowed Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.196 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.627 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 16.5 ptt85 169.27 -27.82 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 120.813 0.339 . . . . 0.0 111.088 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.615 ' O ' ' ND2' ' B' ' 61' ' ' ASN . 0.2 OUTLIER -160.47 42.41 0.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.982 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.6 p90 -96.65 -165.02 1.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.875 0.369 . . . . 0.0 110.784 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.522 ' HA3' ' HB3' ' A' ' 35' ' ' GLU . . . -141.08 111.57 0.72 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.795 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.955 ' CA ' HD12 ' A' ' 57' ' ' ILE . 88.4 p -101.1 128.32 47.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.084 0.469 . . . . 0.0 111.596 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.797 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 48.0 t80 -136.41 67.62 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.143 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.861 HG13 HD11 ' A' ' 57' ' ' ILE . 10.3 m -103.28 169.86 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.376 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 67' ' ' THR . . . . . 1.014 HG21 HG21 ' A' ' 53' ' ' THR . 59.6 m -117.34 80.64 1.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.71 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.834 ' HE1' ' HB ' ' B' ' 70' ' ' THR . 59.7 t-80 -57.37 -129.19 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.945 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.574 ' N ' ' ND1' ' B' ' 68' ' ' HIS . 6.7 pt-20 161.32 -47.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.027 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.834 ' HB ' ' HE1' ' B' ' 68' ' ' HIS . 4.0 m -87.73 -111.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.613 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.584 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -56.97 4.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.66 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.901 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 0.1 OUTLIER 72.4 -74.77 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.64 0.257 . . . . 0.0 110.549 -179.879 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.767 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 4.3 p90 154.94 173.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.215 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 1.036 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -147.17 119.28 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.922 0.391 . . . . 0.0 111.246 179.511 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.764 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 1.4 t80 -103.79 136.55 43.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.351 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.921 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.38 129.19 5.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.975 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.705 ' O ' HG23 ' B' ' 7' ' ' VAL . 2.4 t80 -97.16 113.38 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 0.988 ' HG ' HD11 ' B' ' 29' ' ' LEU . 0.9 OUTLIER -69.47 170.54 10.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.42 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.506 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.54 -41.55 0.01 OUTLIER Glycine 0 C--N 1.33 0.242 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.958 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.521 ' N ' ' O ' ' B' ' 78' ' ' LEU . 51.6 mt-30 -154.02 35.4 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.894 HG13 ' O ' ' B' ' 59' ' ' GLY . 58.6 t -151.16 170.91 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.024 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.942 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.61 154.13 46.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.299 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.942 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -142.71 126.57 14.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.418 . . . . 0.0 111.56 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 1.04 HD23 HG12 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -118.57 95.71 4.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.201 179.439 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.936 HD12 ' HB3' ' B' ' 56' ' ' CYS . 1.7 mp -93.65 123.74 37.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.368 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.756 ' CD1' HG21 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -162.53 123.23 2.48 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.558 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.836 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 2.2 ptmt -100.59 143.78 30.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.956 0.407 . . . . 0.0 110.974 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.598 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -107.23 18.92 21.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.321 0.581 . . . . 0.0 110.48 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.4 -1.222 . . . . 0.0 112.431 -179.946 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.5 mmt . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.849 0.356 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.485 ' O ' ' C ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -104.29 -112.59 0.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.913 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.485 ' C ' ' O ' ' A' ' 2' ' ' CYS . 3.9 p30 31.81 47.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.88 0.372 . . . . 0.0 110.683 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.644 ' NE ' ' HG2' ' A' ' 19' ' ' GLN . 23.7 mmt180 -46.78 -50.69 17.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.237 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 6' ' ' ALA . 8.1 mmmm 60.55 -167.28 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.652 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.081 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 56.72 144.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.216 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.506 HG12 ' HE2' ' A' ' 9' ' ' LYS . 21.4 t -107.69 78.29 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.969 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.995 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -46.38 154.42 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.051 0.453 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.506 ' HE2' HG12 ' A' ' 7' ' ' VAL . 5.6 mmtt -138.53 -19.4 1.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.27 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -168.27 98.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.535 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.735 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -112.13 75.47 0.92 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.748 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.757 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 7.4 m-20 -75.17 38.54 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.251 0.548 . . . . 0.0 109.618 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.871 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -136.26 172.12 13.47 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.626 -179.113 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.871 ' N ' ' HG2' ' A' ' 13' ' ' MET . 8.3 t -54.24 134.74 44.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.285 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.829 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.0 OUTLIER -51.36 -78.95 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.337 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.497 ' HG2' ' N ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -43.33 -27.42 0.25 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.979 0.419 . . . . 0.0 110.352 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.835 ' HG2' ' CG ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -78.71 -35.06 45.45 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.047 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.829 HE21 ' HA ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -74.58 -31.62 62.12 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.818 0.342 . . . . 0.0 110.398 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.644 ' HG2' ' NE ' ' A' ' 4' ' ' ARG . 1.6 mt-30 -72.28 -40.9 67.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 178.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -66.65 -29.67 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.529 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.727 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -66.58 -45.61 78.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.049 179.081 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.764 HG22 ' CD2' ' A' ' 76' ' ' PHE . 84.7 t -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.477 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.406 ' OE2' ' OD1' ' A' ' 3' ' ' ASP . 13.2 mm-40 -58.15 -36.84 73.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.953 0.406 . . . . 0.0 110.081 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.8 t -67.37 -32.68 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.047 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.766 ' C ' HD12 ' A' ' 29' ' ' LEU . . . -73.56 -40.27 64.06 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.874 ' HA ' HD12 ' A' ' 29' ' ' LEU . 87.1 m -64.55 -37.71 88.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.271 -1.332 . . . . 0.0 109.43 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -61.26 -43.09 99.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.493 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.795 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -76.69 -14.5 59.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.996 179.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.874 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.4 mt -82.53 -44.99 15.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.777 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -34.51 64.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.241 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 3.1 mttm -79.13 -28.65 42.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.649 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.636 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.68 149.07 27.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.94 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -116.37 33.53 5.5 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.053 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.976 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 5.7 mm -112.95 107.86 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.964 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.916 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 35.5 mp0 -29.95 -74.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.904 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.505 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -43.54 -59.46 2.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.691 179.767 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.976 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -45.2 -63.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.544 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.795 HG23 ' CB ' ' A' ' 28' ' ' ALA . 7.5 mt -46.79 -52.22 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.126 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 1.076 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -54.16 -36.7 63.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.101 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.805 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -66.23 -67.28 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.115 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.689 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -46.14 -39.93 10.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.754 HG13 ' O ' ' A' ' 38' ' ' ILE . 65.6 mt -62.8 -66.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.966 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.892 ' HE3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -46.61 -47.05 20.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 47' ' ' ASP . 0.8 OUTLIER -52.85 -63.47 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.677 ' OE1' ' HA ' ' A' ' 45' ' ' GLU . 4.5 tp10 -45.61 -58.02 3.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.378 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.727 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 2.1 m-85 -52.93 -39.72 63.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.594 179.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.799 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 3.9 t70 -62.12 -24.96 67.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.345 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.805 ' HE3' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -118.4 4.76 11.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.799 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.625 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -107.74 -14.22 14.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.938 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.797 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 5.6 m-85 -145.51 -63.14 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.24 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.797 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 10.7 p-10 157.0 117.16 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.148 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.799 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 13.8 Cg_endo -56.18 174.82 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.47 2.113 . . . . 0.0 112.22 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 23.4 m -103.66 123.16 46.48 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.14 0.576 . . . . 0.0 110.577 0.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.817 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 51.5 m95 -96.77 126.95 42.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.18 0.514 . . . . 0.0 112.181 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.749 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -106.82 96.99 6.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.504 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.939 ' O ' HD13 ' A' ' 57' ' ' ILE . 18.9 p -111.4 147.08 35.99 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.199 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.963 ' CG1' HD23 ' A' ' 84' ' ' LEU . 18.3 mm -133.03 109.67 14.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.304 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.076 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.1 p -109.42 124.62 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 111.796 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.84 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -146.65 -135.76 2.78 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.061 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -160.89 -20.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.749 0.309 . . . . 0.0 111.312 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.708 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 8.8 m-20 -154.91 35.37 0.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.355 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.917 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 11.2 p90 -101.66 -178.29 3.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.71 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.815 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.73 107.59 0.61 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.82 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.889 ' CB ' HD12 ' B' ' 57' ' ' ILE . 53.6 p -92.41 130.37 38.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.207 0.527 . . . . 0.0 111.713 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.808 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 48.5 t80 -136.67 72.06 1.42 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.099 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.046 HG13 HD11 ' B' ' 57' ' ' ILE . 5.9 m -122.38 136.53 58.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.294 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . 1.055 HG21 HG21 ' B' ' 53' ' ' THR . 7.0 t -67.94 116.78 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.972 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.46 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 21.4 p-80 -87.21 162.83 17.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.736 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.517 ' O ' HG23 ' A' ' 70' ' ' THR . 6.3 pt-20 -158.57 -153.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.949 0.404 . . . . 0.0 111.166 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.517 HG23 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 44.06 -92.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.772 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 170.64 21.02 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.659 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.851 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 31.3 m170 -125.18 61.96 1.18 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.12 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.757 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 7.4 t80 -130.76 97.82 4.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.933 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.926 HG23 ' HE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -115.42 122.88 70.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.804 -179.163 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.593 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 8.0 t80 -114.04 137.11 52.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.299 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.995 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -161.0 173.23 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.183 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.706 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 89.2 t80 -132.87 92.47 3.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.908 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.081 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.1 mm? -42.75 169.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.59 -44.14 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.424 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.567 ' O ' ' NE2' ' A' ' 80' ' ' GLN . 0.0 OUTLIER -148.37 32.62 0.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.84 HG13 ' O ' ' A' ' 59' ' ' GLY . 76.4 t -147.46 171.66 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.65 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.711 ' C ' HD13 ' A' ' 83' ' ' ILE . . . -133.51 144.79 49.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.82 0.343 . . . . 0.0 110.745 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.711 HD13 ' C ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -134.53 124.64 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.077 -179.752 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.963 HD23 ' CG1' ' A' ' 57' ' ' ILE . 0.9 OUTLIER -112.72 88.34 2.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.556 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.79 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -93.35 124.19 37.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.472 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CE1' ' HB2' ' A' ' 55' ' ' HIS . 2.5 p90 -164.11 129.04 2.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.591 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.798 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.53 161.59 13.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.503 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.668 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -120.22 19.64 12.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 0.0 110.434 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.029 0 CA-C-O 118.39 -1.228 . . . . 0.0 112.556 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.474 ' O ' ' C ' ' B' ' 2' ' ' CYS . 14.3 mtt . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.8 0.333 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.474 ' C ' ' O ' ' B' ' 1' ' ' MET . 0.0 OUTLIER 31.9 76.4 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.991 179.855 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.72 141.16 53.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.617 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.558 HH11 ' CB ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER 61.19 87.24 0.09 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.682 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.529 ' HD2' ' O ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER -112.02 40.52 2.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.088 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -115.42 -170.92 1.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.336 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.782 HG12 ' HE3' ' B' ' 9' ' ' LYS . 26.8 t -137.98 66.69 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.801 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.9 OUTLIER -37.21 157.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.132 0.491 . . . . 0.0 110.663 -179.829 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.782 ' HE3' HG12 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -154.44 -11.4 0.13 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.201 179.722 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.519 ' O ' ' N ' ' B' ' 75' ' ' TYR . 3.9 t-20 -166.8 100.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.433 179.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.692 ' HB1' ' OE1' ' B' ' 18' ' ' GLN . . . -128.77 136.77 50.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.019 0.438 . . . . 0.0 111.599 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.572 ' CB ' ' HD2' ' B' ' 68' ' ' HIS . 21.1 t70 -132.63 28.7 4.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.774 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.824 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 13.5 ttp -123.98 151.58 43.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.856 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.783 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 2.1 m -36.52 141.39 0.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.942 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.692 ' HA ' HE21 ' B' ' 18' ' ' GLN . 11.9 mt-10 -46.94 -66.45 0.4 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.184 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.706 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -50.93 -30.57 15.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.773 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.796 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.13 -40.75 74.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.743 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.817 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -66.78 -28.67 68.58 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.849 0.357 . . . . 0.0 110.469 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.706 ' HG2' ' O ' ' B' ' 16' ' ' GLU . 2.6 pt20 -77.36 -42.55 36.08 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.625 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 1.1 m-20 -69.9 -25.03 63.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.79 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.827 ' OG ' HG21 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -70.87 -51.52 25.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.196 179.278 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.818 ' HA ' ' CZ ' ' B' ' 76' ' ' PHE . 60.9 t -57.17 -42.39 79.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.244 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 8.7 mt-10 -61.42 -38.88 88.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.077 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.421 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 65.9 m -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.964 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.76 ' C ' HD12 ' B' ' 29' ' ' LEU . . . -70.23 -33.63 71.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.581 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 1.4 m -66.84 -40.76 88.05 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.43 -1.259 . . . . 0.0 109.487 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 33.0 mt-30 -56.57 -44.92 81.46 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.562 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.729 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -80.25 -15.23 57.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.565 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.886 HD21 HG11 ' B' ' 81' ' ' VAL . 5.7 mt -82.57 -35.71 26.9 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.641 ' OE1' ' HD2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -88.07 -30.19 20.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.188 -179.717 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.641 ' HD2' ' OE1' ' B' ' 30' ' ' GLU . 1.7 mptt -84.39 -9.75 58.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.834 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.611 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.1 OUTLIER -151.1 -150.09 0.33 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.975 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 1.1 t30 177.87 28.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.609 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 1.037 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.8 mm -117.8 106.4 19.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.509 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.815 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 2.3 mp0 -29.67 -62.65 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.924 0.392 . . . . 0.0 110.731 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.626 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -55.1 -51.97 64.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.017 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 1.037 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.5 m-20 -54.44 -61.3 2.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.828 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.875 ' HB ' HG11 ' B' ' 58' ' ' VAL . 2.5 mt -45.78 -48.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.008 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 1.034 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -62.42 -34.2 76.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.808 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -62.4 -62.91 1.43 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.034 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.608 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -53.72 -54.13 42.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.939 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.765 HD11 HG22 ' B' ' 38' ' ' ILE . 73.7 mt -44.06 -66.65 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.277 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.712 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 13.2 tttp -42.82 -50.97 5.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.903 0.382 . . . . 0.0 110.917 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.529 ' HZ2' ' HB3' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -55.9 -45.9 78.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.219 -179.79 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.686 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.0 mt-10 -68.09 -34.88 77.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.15 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.788 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -72.32 -32.63 66.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.991 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.733 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 5.1 m-20 -71.31 -38.0 71.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.915 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.48 -23.67 20.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.688 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.686 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.4 OUTLIER -86.03 -20.53 28.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.359 -179.562 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.555 ' HD2' ' O ' ' B' ' 46' ' ' PHE . 12.7 m-85 -132.09 -66.82 0.69 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.617 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.492 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 7.6 t30 158.93 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.395 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.733 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 20.8 Cg_endo -60.3 171.61 3.11 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.307 2.005 . . . . 0.0 112.333 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' THR . . . . . 1.055 HG21 HG21 ' A' ' 67' ' ' THR . 62.9 m -104.74 131.57 52.02 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 122.917 0.487 . . . . 0.0 111.052 0.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.826 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 46.2 m95 -102.2 157.58 16.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.591 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.771 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 10.2 m-70 -128.91 99.57 5.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.755 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.665 ' O ' HD13 ' B' ' 57' ' ' ILE . 1.8 m -106.26 128.26 53.84 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 1.046 HD11 HG13 ' A' ' 66' ' ' VAL . 17.0 mm -125.32 101.38 8.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.501 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.034 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.7 p -108.77 126.24 65.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 0.0 111.85 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.771 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -144.08 -105.29 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.795 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.661 ' HE ' ' HB3' ' A' ' 61' ' ' ASN . 0.4 OUTLIER 170.91 -33.26 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.67 0.271 . . . . 0.0 111.194 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.46 ' O ' ' OE2' ' A' ' 35' ' ' GLU . 10.0 m120 -145.02 46.72 1.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.125 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.917 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 21.3 p90 -111.0 -173.54 2.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.904 0.383 . . . . 0.0 110.76 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.916 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -138.0 98.53 0.26 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.778 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.916 ' CA ' HD12 ' A' ' 57' ' ' ILE . 1.2 p -86.81 121.99 30.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.223 0.535 . . . . 0.0 111.591 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.892 ' HE2' ' HE3' ' A' ' 43' ' ' LYS . 21.8 t80 -129.14 75.53 1.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.791 HG13 HD11 ' A' ' 57' ' ' ILE . 28.4 m -123.48 164.62 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.336 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.593 HG21 HG21 ' A' ' 53' ' ' THR . 5.3 t -82.91 128.17 34.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.669 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.572 ' HD2' ' CB ' ' B' ' 12' ' ' ASP . 1.8 p-80 -104.11 118.57 36.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.557 ' O ' ' HB ' ' B' ' 70' ' ' THR . 0.8 OUTLIER -123.29 168.73 12.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.707 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.557 ' HB ' ' O ' ' B' ' 69' ' ' GLU . 29.0 m 76.13 -100.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.716 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.631 ' O ' ' HA ' ' B' ' 13' ' ' MET . 2.3 ttpt 173.33 38.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.798 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.826 ' HB3' ' CZ3' ' B' ' 54' ' ' TRP . 2.2 m80 -138.66 46.87 1.97 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.794 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 4.8 t80 -120.69 87.67 2.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.404 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.827 HG21 ' OG ' ' B' ' 21' ' ' SER . 1.2 tt -105.48 144.91 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.045 0.45 . . . . 0.0 111.632 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.8 OUTLIER -134.1 131.18 38.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.195 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.818 ' CZ ' ' HA ' ' B' ' 22' ' ' VAL . 9.7 p90 -158.54 161.7 37.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.991 0.425 . . . . 0.0 111.258 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.737 ' O ' HG23 ' B' ' 7' ' ' VAL . 8.0 t80 -122.23 111.02 16.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.411 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.088 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.41 169.97 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.767 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -23.39 -45.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 113.15 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.581 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 14.3 tt0 -151.4 36.74 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.752 0.311 . . . . 0.0 110.937 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.886 HG11 HD21 ' B' ' 29' ' ' LEU . 86.0 t -152.12 170.18 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.184 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.824 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -133.85 149.94 51.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.824 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -140.11 131.56 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.188 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.982 HD23 ' CG1' ' B' ' 57' ' ' ILE . 2.0 tp -121.34 88.58 2.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.794 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 1.3 mp -92.93 124.54 36.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.069 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.783 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 12.1 p90 -162.72 132.83 4.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.349 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.799 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -93.82 151.87 19.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.534 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.687 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.1 OUTLIER -113.99 19.72 16.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.314 0.578 . . . . 0.0 110.17 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.397 -1.224 . . . . 0.0 112.436 -179.866 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.4 mtm . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.831 0.348 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.1 m 57.74 108.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.815 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.562 ' HB3' HH11 ' A' ' 4' ' ' ARG . 1.2 m-20 -149.1 -145.83 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.088 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.562 HH11 ' HB3' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -33.65 -60.11 0.38 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.206 -179.881 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.414 ' O ' HD13 ' A' ' 78' ' ' LEU . 6.1 tptm 52.74 35.83 19.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.793 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.043 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -136.5 175.3 9.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.212 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.522 ' O ' ' HE3' ' A' ' 9' ' ' LYS . 95.9 t -137.31 77.94 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.758 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.808 HD12 ' HB3' ' A' ' 76' ' ' PHE . 1.2 mp -32.78 148.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.334 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.774 ' HB2' ' CD2' ' A' ' 75' ' ' TYR . 5.0 mmtp -129.45 -14.19 4.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.847 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 1.7 t30 -164.09 -91.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.483 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.993 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 70.09 -173.96 0.18 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.577 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.617 ' HB3' ' HB3' ' A' ' 72' ' ' HIS . 2.8 t0 166.62 28.51 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.471 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.648 ' HG2' ' CB ' ' A' ' 17' ' ' MET . 15.4 ttp -113.76 171.58 7.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.674 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.901 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 1.9 m -48.35 129.17 15.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.877 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.501 ' H ' ' HG2' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -34.39 -79.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.795 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.64 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 2.1 mm-40 -46.07 -22.89 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.901 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -76.14 -39.89 53.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.549 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.835 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -68.47 -38.16 80.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.495 179.625 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.443 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 1.0 OUTLIER -72.98 -36.74 67.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.566 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.64 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.4 t0 -66.78 -39.58 87.86 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.84 179.233 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.985 ' HB2' HD22 ' A' ' 85' ' ' LEU . 1.1 p -60.35 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.74 178.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.809 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 40.1 t -52.74 -50.24 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.303 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 54.2 mt-10 -54.3 -46.78 72.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.22 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.434 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 20.0 m -59.29 -37.31 77.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.034 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.774 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.04 -28.32 66.45 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.8 m -72.93 -39.43 66.28 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.4 -1.273 . . . . 0.0 109.54 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.699 ' O ' ' HD3' ' A' ' 31' ' ' LYS . 15.4 mm100 -56.79 -43.22 80.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.406 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.966 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -75.99 -29.94 58.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.178 179.039 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 1.074 HD21 HG11 ' A' ' 81' ' ' VAL . 3.1 mt -72.71 -30.52 64.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.212 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -95.96 -16.11 21.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.831 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.699 ' HD3' ' O ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -92.5 -23.93 18.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.554 ' HE1' ' HA ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -163.49 134.84 4.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.754 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -96.11 39.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.894 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.713 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 40.2 mm -117.59 102.16 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.001 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.653 ' OE2' ' HD3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -22.25 -89.43 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.423 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -37.03 -42.88 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.727 179.967 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.713 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 24.2 t0 -57.96 -56.54 20.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.517 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.966 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.8 mt -52.04 -45.72 41.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.838 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -61.87 -45.72 92.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.802 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -56.2 -64.34 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.286 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.909 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -38.8 -52.68 1.72 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.02 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.902 HG21 HD11 ' A' ' 85' ' ' LEU . 16.9 mt -55.91 -68.17 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.203 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.61 ' C ' ' HE2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -37.34 -63.03 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.204 -179.848 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -43.92 -57.19 3.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.418 . . . . 0.0 111.037 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.586 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -53.51 -57.03 12.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.205 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.797 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -55.03 -34.82 63.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.554 ' HB2' ' CE ' ' A' ' 43' ' ' LYS . 17.6 t70 -73.54 -20.88 60.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.57 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.74 ' HE3' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -121.38 10.53 10.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.586 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.8 OUTLIER -128.18 3.35 5.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.547 -179.431 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.58 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 95.7 m-85 -147.07 -63.12 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.497 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 18.8 p-10 161.56 110.87 0.01 OUTLIER Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.109 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.483 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 86.1 Cg_exo -45.96 151.06 1.55 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.311 2.008 . . . . 0.0 112.578 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.684 HG21 HG21 ' B' ' 67' ' ' THR . 95.1 m -118.74 136.17 54.11 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.162 0.585 . . . . 0.0 110.353 -0.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.809 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 65.3 m95 -101.48 144.8 29.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.27 0.557 . . . . 0.0 111.993 -179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.926 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 0.0 OUTLIER -130.26 103.39 6.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.847 178.854 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.851 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.37 162.64 18.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.404 0.621 . . . . 0.0 112.496 -178.176 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.993 HD12 ' HA ' ' B' ' 64' ' ' SER . 26.2 mm -131.77 172.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.977 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.937 HG11 ' HB ' ' A' ' 38' ' ' ILE . 7.3 p -169.33 114.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.946 0.403 . . . . 0.0 111.563 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.569 ' HA2' ' CG ' ' A' ' 35' ' ' GLU . . . -141.07 -140.06 3.78 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.801 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.653 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -162.78 6.09 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.427 ' O ' ' OE2' ' B' ' 35' ' ' GLU . 0.6 OUTLIER -179.99 32.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.76 0.314 . . . . 0.0 111.205 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.955 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -101.12 -169.1 1.65 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.097 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.606 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.41 93.98 0.17 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.849 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.783 ' HB3' HD13 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -82.72 134.15 35.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 0.0 111.498 -179.244 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.761 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 19.7 t80 -143.34 65.29 1.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.256 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.813 HG21 ' CE2' ' A' ' 86' ' ' PHE . 2.8 m -113.94 153.7 15.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.357 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.607 HG22 ' CE1' ' B' ' 55' ' ' HIS . 3.4 t -62.57 -162.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.951 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.621 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -156.85 150.16 24.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.915 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.733 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -143.48 175.03 10.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 179.894 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 72' ' ' HIS . 3.5 m 42.37 -114.57 0.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.662 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.857 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 4.2 mmtm -69.87 24.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.762 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 51.1 m-70 62.54 -88.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.69 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.762 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 0.2 OUTLIER 162.58 -169.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.604 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.993 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -161.12 141.37 3.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.443 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.774 ' CD2' ' HB2' ' A' ' 9' ' ' LYS . 7.8 t80 -131.54 139.47 49.25 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.787 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.809 ' CE2' ' HA ' ' A' ' 22' ' ' VAL . 0.2 OUTLIER -161.55 176.42 11.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.845 0.355 . . . . 0.0 111.097 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.751 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 42.4 t80 -135.48 97.21 3.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.201 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.043 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -60.3 -169.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.457 179.695 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.565 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -61.73 93.08 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.07 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.565 ' HB2' ' O ' ' A' ' 79' ' ' GLY . 30.0 mm-40 71.1 15.9 6.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.117 0.484 . . . . 0.0 110.268 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 1.074 HG11 HD21 ' A' ' 29' ' ' LEU . 55.2 t -136.84 164.91 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.775 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.814 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -138.37 151.87 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.69 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.874 ' CD1' HG23 ' A' ' 58' ' ' VAL . 0.2 OUTLIER -140.41 126.42 21.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.884 0.374 . . . . 0.0 111.398 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.9 HD23 HG12 ' A' ' 57' ' ' ILE . 0.9 OUTLIER -112.02 93.37 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.985 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -92.21 147.44 22.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.173 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.813 ' CE2' HG21 ' A' ' 66' ' ' VAL . 5.9 p90 179.33 119.02 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.182 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.857 ' HZ3' ' HG2' ' A' ' 71' ' ' LYS . 2.3 ptmt -101.12 150.97 22.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.926 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 0.5 OUTLIER -103.7 20.68 17.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.242 0.544 . . . . 0.0 110.911 -179.847 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.559 ' HA3' ' OG1' ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.349 -1.251 . . . . 0.0 112.364 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.6 mmm . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.805 0.336 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.549 ' O ' ' NH1' ' B' ' 4' ' ' ARG . 12.1 t -107.66 67.74 0.69 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.746 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.68 ' O ' ' HD3' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -108.98 177.75 4.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.017 -179.99 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.68 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 0.0 OUTLIER -175.01 -65.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.831 -179.987 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.498 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.6 OUTLIER 32.49 40.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.261 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.049 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -131.78 -176.27 3.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.278 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.557 ' N ' ' O ' ' B' ' 77' ' ' TYR . 45.0 t -145.73 72.41 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.922 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.807 HD12 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -33.15 147.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 110.583 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.546 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 0.5 OUTLIER -134.35 -12.39 2.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.686 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 173.6 103.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.826 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.686 ' HB1' ' HG2' ' B' ' 18' ' ' GLN . . . -130.4 154.12 48.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.454 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.945 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 26.6 m-20 -146.98 27.51 1.06 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.339 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.91 ' SD ' ' HG3' ' B' ' 71' ' ' LYS . 10.7 ttp -108.26 178.02 4.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.598 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.764 ' H ' ' HG3' ' B' ' 13' ' ' MET . 3.5 m -58.76 128.6 38.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.806 0.336 . . . . 0.0 111.015 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.525 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 1.6 mt-10 -33.35 -70.06 0.08 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.747 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 3.4 mm-40 -55.22 -26.51 39.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.272 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.793 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 38.5 mmm -72.56 -34.67 67.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.822 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.96 ' CA ' HD12 ' B' ' 74' ' ' ILE . 4.2 mt-30 -72.41 -48.62 39.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.022 0.439 . . . . 0.0 110.663 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.768 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 14.5 mm-40 -68.3 -23.43 64.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.779 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER -79.11 -34.89 43.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.86 179.166 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.897 ' OG ' HG21 ' B' ' 74' ' ' ILE . 0.2 OUTLIER -65.96 -41.49 91.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.883 179.075 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.887 HG22 ' CD2' ' B' ' 76' ' ' PHE . 95.4 t -63.85 -50.17 78.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.262 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.768 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 39.7 mt-10 -51.94 -40.91 61.56 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.491 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.744 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 48.6 t -66.7 -37.59 85.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.321 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.749 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -69.56 -28.8 66.29 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.618 ' HA ' HD12 ' B' ' 29' ' ' LEU . 4.7 m -70.82 -43.31 68.88 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 114.329 -1.305 . . . . 0.0 109.513 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.744 ' HG3' ' HA ' ' B' ' 24' ' ' CYS . 15.0 mt-30 -53.5 -47.3 69.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.717 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.872 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -76.21 -20.19 57.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.632 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.734 ' CD1' ' HG ' ' B' ' 78' ' ' LEU . 5.9 mt -74.89 -39.89 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.272 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.47 -30.56 27.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.382 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.561 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 7.2 mttt -82.04 -33.34 30.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.0 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.775 ' CE1' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -144.44 157.12 44.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.413 ' C ' HD13 ' B' ' 34' ' ' ILE . 2.9 p30 -123.54 29.36 6.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.214 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 1.094 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 4.0 mm -107.68 108.0 24.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.7 ' O ' HG13 ' B' ' 58' ' ' VAL . 0.3 OUTLIER -29.79 -71.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.132 -179.512 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.52 ' H ' ' HG2' ' B' ' 36' ' ' LYS . 0.5 OUTLIER -50.03 -54.67 18.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.866 0.365 . . . . 0.0 110.647 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 1.094 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.3 m-20 -46.11 -64.65 0.7 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.911 ' HB ' HG11 ' B' ' 58' ' ' VAL . 4.8 mt -44.56 -56.01 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.253 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 1.006 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.88 -38.32 70.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.471 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.761 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -57.59 -58.83 6.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.218 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.775 ' CD2' ' CE1' ' B' ' 32' ' ' TYR . 0.1 OUTLIER -58.07 -33.93 69.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.13 -179.82 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.767 HG13 ' O ' ' B' ' 38' ' ' ILE . 62.5 mt -66.05 -69.51 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.572 ' HB3' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -45.11 -37.28 4.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.962 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.606 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 43.3 mmtt -71.14 -51.67 23.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 111.023 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.505 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.6 mt-10 -62.69 -25.58 68.23 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.947 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.805 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -75.61 -47.49 26.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.617 179.912 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.74 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.9 OUTLIER -64.94 -24.68 67.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.304 179.642 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.716 ' C ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -89.85 -42.76 11.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.625 179.863 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.668 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.8 tttp -83.0 -14.17 54.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.05 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.779 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 58.0 m-85 -128.88 -71.38 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.435 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.501 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 10.1 t30 156.22 119.22 0.0 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.18 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.74 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 19.0 Cg_endo -59.23 168.9 4.27 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 122.495 2.13 . . . . 0.0 112.661 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.452 HG21 HG21 ' A' ' 67' ' ' THR . 1.7 t -108.5 125.31 51.66 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 122.885 0.474 . . . . 0.0 110.54 0.108 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.808 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 42.8 m95 -95.92 168.56 10.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.584 0.707 . . . . 0.0 112.107 -179.195 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.755 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 8.4 m-70 -131.09 96.19 3.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.584 178.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.597 ' O ' ' HB1' ' B' ' 39' ' ' ALA . 78.9 m -104.44 122.49 45.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.201 0.524 . . . . 0.0 112.116 -178.026 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.783 HD13 ' HB3' ' A' ' 64' ' ' SER . 7.7 mt -127.77 109.16 19.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.382 179.015 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.006 HG12 ' HB2' ' B' ' 39' ' ' ALA . 1.6 p -111.04 118.65 57.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.321 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.929 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -138.79 -126.15 2.37 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.889 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.728 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -169.7 10.03 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.687 0.28 . . . . 0.0 111.147 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.728 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.1 OUTLIER 163.64 32.82 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.994 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.955 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.2 p90 -82.86 173.08 12.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.023 0.439 . . . . 0.0 111.004 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.94 76.88 0.32 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.894 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.993 ' HA ' HD12 ' A' ' 57' ' ' ILE . 53.1 p -72.52 122.2 20.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 0.0 111.415 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.802 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 23.3 t80 -133.92 77.39 1.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.309 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.969 HG21 ' CZ ' ' B' ' 86' ' ' PHE . 6.1 m -115.14 163.89 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.497 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.684 HG21 HG21 ' A' ' 53' ' ' THR . 19.7 m -95.62 73.33 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.464 179.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.62 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -46.57 179.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.4 -179.536 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.62 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -179.49 -177.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.467 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.527 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 56.13 -120.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.818 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.91 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.72 17.42 0.07 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.943 0.402 . . . . 0.0 110.672 179.82 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.945 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 17.7 m170 68.53 -90.36 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.827 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.744 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 1.0 OUTLIER 157.87 -164.68 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.566 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.96 HD12 ' CA ' ' B' ' 18' ' ' GLN . 0.2 OUTLIER -162.76 116.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.479 ' OH ' ' CZ ' ' B' ' 62' ' ' PHE . 1.1 t80 -107.02 134.65 49.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.29 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.887 ' CD2' HG22 ' B' ' 22' ' ' VAL . 2.9 p90 -152.35 165.34 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.086 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.589 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 26.7 t80 -126.33 108.95 11.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.049 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -69.86 170.47 11.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.763 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.477 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.97 -37.34 0.01 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.917 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.589 ' N ' ' O ' ' B' ' 78' ' ' LEU . 4.6 tt0 -158.5 41.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.745 0.307 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.929 HG13 ' O ' ' B' ' 59' ' ' GLY . 69.8 t -157.79 164.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.009 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.596 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -133.44 111.74 10.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.662 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.749 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -101.33 133.37 44.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.973 0.416 . . . . 0.0 111.482 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.622 HD23 HG13 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -119.74 103.92 9.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.156 179.628 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.744 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 4.3 mp -107.22 117.11 33.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.52 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.969 ' CZ ' HG21 ' B' ' 66' ' ' VAL . 25.1 p90 -153.34 138.39 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.925 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.808 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 5.3 mtpm? -100.65 159.63 15.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 111.207 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.43 19.33 14.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.818 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 89' ' ' GLY . . . . . 0.409 ' CA ' ' OG1' ' B' ' 70' ' ' THR . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.424 -1.209 . . . . 0.0 112.567 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.6 tpp . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.728 0.299 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.611 ' HB3' ' OD1' ' A' ' 3' ' ' ASP . 0.1 OUTLIER -139.06 -64.36 0.51 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.901 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.611 ' OD1' ' HB3' ' A' ' 2' ' ' CYS . 0.0 OUTLIER -120.98 -156.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 3' ' ' ASP . 2.3 mpp_? 66.67 -77.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.895 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.419 ' C ' HD13 ' A' ' 78' ' ' LEU . 0.1 OUTLIER 56.5 29.25 15.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.73 -179.865 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.047 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -123.9 -178.82 4.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.205 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.793 HG12 ' HE2' ' A' ' 9' ' ' LYS . 93.3 t -133.92 73.86 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.009 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.819 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -39.59 155.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.267 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.793 ' HE2' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -146.41 -10.03 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.567 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.442 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER 179.11 97.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.632 179.813 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.898 ' HB1' ' OE1' ' A' ' 18' ' ' GLN . . . -127.44 94.95 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.666 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 72' ' ' HIS . 88.1 m-20 -90.33 30.93 1.05 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.285 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.913 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.1 OUTLIER -116.59 166.83 11.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.644 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.89 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -45.65 122.94 3.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.797 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.636 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -38.01 -73.58 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.948 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.48 ' OE1' ' HA ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -44.52 -28.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.754 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.913 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -73.02 -43.63 61.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.812 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.971 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -59.9 -36.39 76.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.725 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.462 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 13.5 mt-30 -75.43 -39.77 58.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.137 0.494 . . . . 0.0 109.923 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.409 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -68.48 -29.01 67.53 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.41 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.833 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -68.53 -45.92 70.95 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.785 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 18' ' ' GLN . 17.4 t -56.55 -44.19 80.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.211 178.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 62.0 mt-10 -59.61 -41.58 90.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.269 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.739 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 53.6 t -65.08 -34.69 79.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.257 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.81 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -73.14 -32.98 65.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.622 ' HA ' HD12 ' A' ' 29' ' ' LEU . 23.5 m -70.22 -36.9 74.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.565 178.583 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.815 ' HB3' ' NE2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -62.31 -42.28 99.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.758 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.92 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -69.88 -28.94 66.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.859 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.81 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.5 mt -71.12 -58.7 3.3 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.813 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -36.61 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.859 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.788 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 15.1 mmtp -79.45 -35.77 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.887 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.605 ' HE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -153.56 152.11 30.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.886 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.93 ' HA ' HD11 ' A' ' 38' ' ' ILE . 9.3 m-20 -128.46 40.37 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.534 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.707 HG22 ' O ' ' A' ' 34' ' ' ILE . 33.2 mm -107.5 49.26 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.232 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.855 ' HG3' ' HA2' ' A' ' 59' ' ' GLY . 0.0 OUTLIER 34.72 -89.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.378 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.603 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -41.33 -46.9 3.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.987 0.422 . . . . 0.0 110.52 179.338 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.622 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 61.0 t0 -54.19 -61.13 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.81 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.93 HD11 ' HA ' ' A' ' 33' ' ' ASN . 3.5 mt -48.12 -50.72 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.078 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 1.031 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -52.13 -51.47 57.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.803 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -52.79 -51.31 61.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.698 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.851 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.6 OUTLIER -52.14 -47.0 65.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.55 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.931 HG21 HD11 ' A' ' 85' ' ' LEU . 37.1 mt -55.17 -71.88 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.189 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.784 ' HB3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -37.61 -55.2 1.14 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.997 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -44.26 -62.35 1.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.13 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.773 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 1.3 tp10 -55.54 -62.04 1.95 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.091 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.1 m-85 -41.67 -49.61 4.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.949 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.788 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 1.6 m-20 -56.58 -39.74 74.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.1 6.54 43.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.248 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.773 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -108.89 -20.72 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.098 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CE2' ' CD2' ' A' ' 46' ' ' PHE . 14.1 m-85 -140.62 -58.55 0.52 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.417 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.651 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 0.4 OUTLIER 159.21 118.37 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.292 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.788 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 29.3 Cg_endo -62.39 171.37 5.48 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 122.561 2.174 . . . . 0.0 112.407 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.795 HG21 HG21 ' B' ' 67' ' ' THR . 20.6 m -104.9 134.46 47.97 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 122.981 0.512 . . . . 0.0 110.648 0.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.807 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.6 m95 -105.7 145.45 31.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.49 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 1.053 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 0.2 OUTLIER -121.69 101.8 7.81 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.747 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.869 ' O ' HD13 ' A' ' 57' ' ' ILE . 8.6 p -107.66 146.79 31.56 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.087 HD12 ' HB2' ' B' ' 64' ' ' SER . 29.6 mm -134.47 107.37 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.548 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.031 HG12 ' HB2' ' A' ' 39' ' ' ALA . 7.2 p -107.86 116.35 51.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.545 -179.466 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.94 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -134.97 -134.11 3.35 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.192 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.715 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -167.36 11.12 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 120.827 0.346 . . . . 0.0 111.137 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.715 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 29.1 t-20 165.55 31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.909 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 3.0 p90 -91.32 -175.28 4.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.781 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.65 ' N ' ' HD1' ' A' ' 62' ' ' PHE . . . -138.41 101.32 0.32 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.87 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.98 ' CB ' HD12 ' B' ' 57' ' ' ILE . 87.6 p -87.45 144.88 26.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.196 0.522 . . . . 0.0 111.72 -179.297 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.759 ' H ' HD13 ' B' ' 57' ' ' ILE . 22.9 t80 -152.2 64.95 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.012 HG13 HD11 ' B' ' 57' ' ' ILE . 27.2 m -104.8 160.73 5.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.6 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.819 HG21 HG21 ' B' ' 53' ' ' THR . 2.3 m -87.0 -17.79 32.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.96 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.835 ' HB3' ' HB2' ' A' ' 86' ' ' PHE . 6.4 p-80 35.55 -157.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.714 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER 167.6 -155.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.91 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.533 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 41.65 -98.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.671 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.579 ' O ' ' HB2' ' A' ' 13' ' ' MET . 1.4 mmtp -91.27 32.83 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.712 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.726 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.2 OUTLIER 52.99 -88.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.95 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.726 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 28.0 p90 165.46 -174.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.007 0.432 . . . . 0.0 111.125 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 1.0 HG23 ' HE1' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -154.03 129.69 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.887 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.593 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -117.05 137.23 52.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.496 179.644 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 1.0 ' HE1' HG23 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -162.46 163.7 27.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.902 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.767 ' HE1' ' HA ' ' A' ' 80' ' ' GLN . 6.3 t80 -130.55 103.64 6.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.156 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.047 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.0 mm? -60.21 -178.82 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.833 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.02 -53.56 0.08 OUTLIER Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.54 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.767 ' HA ' ' HE1' ' A' ' 77' ' ' TYR . 0.3 OUTLIER -147.77 34.47 0.84 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.014 0.435 . . . . 0.0 110.415 179.468 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.94 HG13 ' O ' ' A' ' 59' ' ' GLY . 91.5 t -143.69 167.61 12.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.912 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.821 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -131.68 151.97 51.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.542 179.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.821 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.1 OUTLIER -138.84 134.06 42.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.995 0.426 . . . . 0.0 111.375 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.925 HD23 ' CG1' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -122.5 91.65 3.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.957 179.532 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.931 HD11 HG21 ' A' ' 42' ' ' ILE . 2.1 mp -93.71 125.28 38.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.63 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.835 ' HB2' ' HB3' ' A' ' 68' ' ' HIS . 27.9 p90 -158.95 122.54 3.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.807 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 40.3 mtpt -80.4 165.44 22.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.615 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' SER . . . . . 1.053 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -115.37 19.93 15.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.243 0.544 . . . . 0.0 110.634 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLY . . . . . 0.472 ' HA2' ' OG1' ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.085 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.405 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.875 0.369 . . . . 0.0 111.179 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.458 ' HA ' ' OE2' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -130.77 40.72 3.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.875 179.88 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -18.09 38.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.112 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.854 HH11 ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER 47.1 21.87 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.997 0.427 . . . . 0.0 110.723 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.644 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.1 OUTLIER -42.67 129.66 4.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.051 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.752 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.93 165.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.88 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.646 ' CG1' ' HE2' ' B' ' 9' ' ' LYS . 71.7 t -132.17 66.98 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.945 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.956 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.08 153.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.185 0.517 . . . . 0.0 110.731 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.748 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 0.9 OUTLIER -154.01 -4.95 0.17 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.565 ' O ' ' N ' ' B' ' 75' ' ' TYR . 1.6 m-20 -173.12 86.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.361 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.978 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -121.24 84.71 2.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.947 -179.28 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.531 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 0.3 OUTLIER -75.9 40.57 0.2 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.408 179.205 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.718 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 16.5 ttp -132.11 166.21 22.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.791 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.0 m -52.25 143.56 14.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.929 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 10.9 mt-10 -48.31 -65.82 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.993 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.482 ' H ' ' HG3' ' B' ' 16' ' ' GLU . 0.1 OUTLIER -51.74 -29.25 17.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.852 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.657 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -72.98 -32.04 64.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.827 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -76.1 -34.87 59.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.674 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.676 ' HG3' ' NH1' ' B' ' 4' ' ' ARG . 2.6 mp0 -75.8 -38.28 58.35 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.36 -30.85 66.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.652 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.772 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 77.5 p -67.77 -44.48 77.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.819 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' B' ' 76' ' ' PHE . 81.4 t -59.48 -50.19 80.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.477 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.458 ' OE2' ' HA ' ' B' ' 2' ' ' CYS . 3.7 mm-40 -55.0 -40.64 70.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.305 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 9.1 m -65.61 -35.24 80.24 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.813 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.673 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -71.8 -30.28 65.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.605 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 34.3 m -72.68 -39.35 67.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.593 178.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.671 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -55.99 -45.34 79.02 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.237 178.82 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.69 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -76.13 -22.17 55.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.042 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.881 HD21 HG11 ' B' ' 81' ' ' VAL . 4.6 mt -75.46 -34.17 60.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.651 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -90.0 -25.12 21.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.931 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.802 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.8 mmtm -85.2 -27.62 26.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.531 179.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.802 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -151.81 163.39 39.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.464 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.431 ' O ' ' CG ' ' B' ' 33' ' ' ASN . 28.4 t-20 -128.39 39.25 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.085 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.975 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 18.2 mm -120.54 104.41 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.9 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.727 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 0.8 OUTLIER -29.64 -66.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.045 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.756 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -51.75 -50.43 60.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.791 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.975 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.6 OUTLIER -53.84 -61.99 1.94 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.905 0.383 . . . . 0.0 110.44 179.695 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.861 ' HB ' HG11 ' B' ' 58' ' ' VAL . 5.0 mt -44.46 -48.65 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.017 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.878 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -58.98 -43.63 91.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.152 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.739 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -55.58 -64.51 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.921 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.69 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -51.31 -57.17 9.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.755 HD11 HG22 ' B' ' 38' ' ' ILE . 87.8 mt -43.52 -62.67 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.679 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 4.6 tttt -53.93 -30.67 47.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.576 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' B' ' 41' ' ' HIS . 3.9 mttt -68.38 -48.55 64.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.207 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.466 ' O ' ' CB ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -68.11 -42.16 80.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.665 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.772 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -63.26 -33.39 75.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.892 -179.922 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.785 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.7 OUTLIER -71.11 -49.22 46.6 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.96 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.403 ' HE3' ' HA ' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -79.14 -21.67 46.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.549 -179.485 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.804 ' HD3' ' O ' ' B' ' 49' ' ' LYS . 0.4 OUTLIER -90.53 -30.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.609 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.559 ' HD2' ' HA ' ' B' ' 46' ' ' PHE . 87.4 m-85 -115.52 -64.48 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.747 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 6.0 t30 158.94 114.37 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.183 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 85.1 Cg_exo -47.3 152.83 2.06 Favored 'Trans proline' 0 CA--C 1.533 0.426 0 C-N-CA 122.284 1.99 . . . . 0.0 112.659 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.819 HG21 HG21 ' A' ' 67' ' ' THR . 8.9 t -122.82 126.0 46.54 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 122.921 0.488 . . . . 0.0 111.036 0.116 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.999 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 44.5 m95 -90.62 117.16 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.747 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.782 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -96.07 109.16 21.62 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.497 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 1.095 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.5 OUTLIER -123.52 149.91 44.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.354 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 1.012 HD11 HG13 ' A' ' 66' ' ' VAL . 23.2 mm -130.76 109.79 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 0.878 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.8 p -110.27 125.67 67.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.93 0.395 . . . . 0.0 111.232 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.731 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -138.37 -128.28 2.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.965 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.746 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.6 OUTLIER -165.3 5.78 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.707 0.289 . . . . 0.0 111.613 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.746 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 2.0 t-20 164.32 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.81 0.338 . . . . 0.0 110.974 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.909 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -87.4 -171.15 3.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.043 0.449 . . . . 0.0 110.845 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.606 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -136.97 77.58 0.34 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.884 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' SER . . . . . 1.087 ' HB2' HD12 ' A' ' 57' ' ' ILE . 5.8 p -70.55 142.21 51.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.031 0.444 . . . . 0.0 111.23 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.863 ' H ' HD13 ' A' ' 57' ' ' ILE . 48.8 t80 -146.04 76.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.356 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.994 HG13 HD11 ' A' ' 57' ' ' ILE . 4.4 m -125.02 131.08 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.272 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.795 HG21 HG21 ' A' ' 53' ' ' THR . 2.6 t -78.31 130.61 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.024 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.494 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.1 OUTLIER -72.65 177.45 4.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.673 ' O ' HG23 ' B' ' 70' ' ' THR . 0.7 OUTLIER -163.97 38.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.247 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.673 HG23 ' O ' ' B' ' 69' ' ' GLU . 0.1 OUTLIER 178.99 -113.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.134 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.535 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -158.63 25.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.792 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 1.0 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 24.7 m-70 -124.58 44.82 2.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.795 ' HA ' ' HA ' ' B' ' 86' ' ' PHE . 8.1 t80 -124.33 90.51 3.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.545 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.978 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.8 OUTLIER -106.74 132.04 55.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.047 0.451 . . . . 0.0 111.508 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.699 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 18.3 t80 -119.78 134.04 55.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.818 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.956 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.1 OUTLIER -161.37 166.84 26.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.984 0.421 . . . . 0.0 111.16 -179.672 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.621 ' HB3' ' HB ' ' B' ' 7' ' ' VAL . 6.4 t80 -128.06 111.7 13.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.894 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 0.752 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.62 166.52 18.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.458 179.763 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.43 -60.85 0.1 Allowed Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.502 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.81 36.15 3.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.288 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.881 HG11 HD21 ' B' ' 29' ' ' LEU . 68.9 t -152.15 169.78 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.566 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.713 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -137.02 147.49 46.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.983 0.42 . . . . 0.0 110.998 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.741 HG13 ' CE2' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -133.26 131.7 58.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.074 -179.812 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.971 HD23 ' CG1' ' B' ' 57' ' ' ILE . 3.3 tp -123.83 83.73 2.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.701 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 1.095 HD12 ' HB2' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -87.45 131.85 34.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.007 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.795 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -160.98 125.6 3.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 1.0 ' HB2' ' HB2' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -105.54 143.75 33.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.737 179.879 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.782 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -91.47 19.47 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.251 0.548 . . . . 0.0 110.735 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 89' ' ' GLY . . . . . 0.618 ' O ' ' HE2' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.447 -1.196 . . . . 0.0 112.511 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.586 ' C ' ' SG ' ' A' ' 2' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.789 0.328 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.586 ' SG ' ' C ' ' A' ' 1' ' ' MET . 0.2 OUTLIER -165.29 83.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.797 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 169.61 166.53 0.05 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.841 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.419 ' H ' ' HG2' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -57.08 -76.32 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.066 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.413 ' HD2' ' HA ' ' A' ' 5' ' ' LYS . 0.4 OUTLIER 66.05 28.61 10.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.683 -179.695 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.075 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.61 169.19 12.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.564 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 47.6 t -120.96 82.8 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.904 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -55.18 136.52 17.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.117 0.484 . . . . 0.0 110.639 -179.885 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.564 ' HE2' ' CG1' ' A' ' 7' ' ' VAL . 0.5 OUTLIER -125.19 -12.85 6.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.041 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.6 ' O ' ' N ' ' A' ' 75' ' ' TYR . 29.9 t30 -176.51 122.85 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.356 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.783 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -149.89 91.03 1.74 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.816 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -75.32 28.52 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.139 0.495 . . . . 0.0 109.841 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.889 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 2.0 ttm -114.14 163.28 15.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.77 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.777 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.2 OUTLIER -56.9 137.78 54.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.644 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.1 mp0 -41.76 -78.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 16' ' ' GLU . 2.8 mm-40 -40.02 -27.29 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.779 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.842 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.4 -42.44 53.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.849 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.883 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -64.85 -32.86 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.894 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.403 ' OE1' ' NH2' ' A' ' 4' ' ' ARG . 20.4 mt-30 -76.28 -42.04 46.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.157 0.503 . . . . 0.0 109.717 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.49 -30.73 67.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.669 179.058 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.823 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 21.9 t -66.84 -45.1 79.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 18' ' ' GLN . 46.8 t -59.98 -46.74 93.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.31 -40.74 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.071 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.786 ' HA ' ' HG3' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -66.23 -38.45 87.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.079 179.361 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.724 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -68.61 -26.93 65.61 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.547 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.3 m -73.84 -40.23 63.46 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.795 178.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.786 ' HG3' ' HA ' ' A' ' 24' ' ' CYS . 7.0 mt-30 -56.87 -44.34 82.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.75 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.853 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -79.45 -21.83 44.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.544 179.376 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 1.093 HD21 HG11 ' A' ' 81' ' ' VAL . 6.5 mt -73.25 -44.09 60.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.084 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -81.48 -29.64 33.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.075 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.493 ' CB ' ' CE1' ' A' ' 32' ' ' TYR . 2.4 mttm -77.77 -36.13 50.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.757 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.627 ' CD1' ' N ' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -150.33 151.8 33.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.815 179.693 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 1.043 ' HA ' HD11 ' A' ' 38' ' ' ILE . 1.6 m-80 -125.88 35.44 4.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.074 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.978 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 36.2 mm -98.44 32.09 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.099 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.756 ' N ' HD12 ' A' ' 38' ' ' ILE . 4.1 mp0 41.24 -86.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.376 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.615 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.75 -50.98 5.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.307 179.26 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.978 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.9 OUTLIER -53.99 -54.24 41.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.323 179.368 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 1.043 HD11 ' HA ' ' A' ' 33' ' ' ASN . 4.7 mt -54.33 -59.08 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.829 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 1.015 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -48.74 -40.38 28.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.779 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -54.66 -67.59 0.25 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.81 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.624 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -49.05 -45.72 43.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.76 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.796 HD11 HG22 ' A' ' 38' ' ' ILE . 58.7 mt -49.96 -48.8 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.969 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.651 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 8.4 tmtt? -66.81 -59.64 3.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.472 ' O ' ' OD1' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -40.04 -57.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.958 0.409 . . . . 0.0 110.971 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.697 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 1.6 tp10 -60.93 -38.25 85.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.263 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.823 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -69.19 -27.23 65.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.085 -179.651 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.816 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -90.3 -13.95 34.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 0.0 110.414 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.609 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -111.39 -8.8 14.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.611 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.725 ' HD2' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -106.56 -23.1 12.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.216 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.725 ' CE1' ' HD2' ' A' ' 49' ' ' LYS . 3.9 m-85 -123.94 -62.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.518 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.483 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 1.3 t30 156.19 121.98 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.973 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.816 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 31.4 Cg_endo -63.03 172.26 5.17 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.646 2.231 . . . . 0.0 112.686 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.666 HG22 ' CE1' ' A' ' 55' ' ' HIS . 36.0 m -102.08 133.72 46.47 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 122.819 0.448 . . . . 0.0 110.492 -0.035 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.767 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 56.0 m95 -104.23 140.23 38.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.286 0.565 . . . . 0.0 112.147 -179.081 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 1.062 ' CE1' ' HB2' ' A' ' 88' ' ' SER . 0.1 OUTLIER -130.43 99.83 5.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.212 -0.903 . . . . 0.0 108.811 178.767 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 1.063 ' HB2' HD12 ' A' ' 85' ' ' LEU . 0.5 OUTLIER -116.89 167.81 10.79 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -177.648 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.958 HD13 ' O ' ' A' ' 56' ' ' CYS . 17.5 mm -135.14 156.49 39.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.789 178.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.015 HG12 ' HB2' ' A' ' 39' ' ' ALA . 10.0 p -158.9 109.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.935 0.397 . . . . 0.0 111.629 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.855 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -139.44 -130.76 2.75 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.019 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.628 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -164.04 -28.9 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 120.737 0.303 . . . . 0.0 111.416 -179.678 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.45 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 53.0 t30 -152.88 45.98 0.69 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.964 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 1.009 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -103.0 -163.26 0.98 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.973 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.817 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.43 90.84 0.15 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.073 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.96 ' HA ' HG12 ' B' ' 57' ' ' ILE . 3.3 p -78.28 147.05 34.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.407 . . . . 0.0 111.22 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.828 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 13.2 t80 -154.6 62.61 0.67 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.645 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.74 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 4.5 m -124.59 140.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.324 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.901 ' CG2' HG21 ' B' ' 53' ' ' THR . 15.2 t -86.16 149.91 24.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.706 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.429 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -78.3 -157.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.937 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.1 OUTLIER -140.86 -51.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.764 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 t -141.01 -60.37 0.49 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.868 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.764 ' HG2' ' C ' ' A' ' 70' ' ' THR . 0.0 OUTLIER -157.03 -136.88 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.776 -179.933 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.853 ' HA ' ' HG3' ' A' ' 13' ' ' MET . 2.9 m-70 31.75 35.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.889 ' N ' ' HB2' ' A' ' 13' ' ' MET . 6.5 t80 -116.73 100.69 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.748 0.309 . . . . 0.0 110.735 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.815 HD11 HD11 ' A' ' 8' ' ' ILE . 2.4 tt -117.19 153.17 18.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.969 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 10' ' ' ASN . 10.0 t80 -149.83 93.23 2.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.66 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.904 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -113.78 -176.17 2.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.33 -179.51 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.623 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 31.1 t80 -143.0 91.03 2.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.811 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.075 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -49.4 174.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.927 -179.945 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.461 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.19 -59.95 0.26 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.577 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -133.57 34.05 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.753 0.311 . . . . 0.0 110.729 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 1.093 HG11 HD21 ' A' ' 29' ' ' LEU . 96.2 t -148.97 164.22 4.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.272 -179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.992 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -129.95 153.18 48.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.59 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.992 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.1 OUTLIER -144.5 118.49 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.373 . . . . 0.0 111.039 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.868 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 6.5 tp -107.48 86.55 2.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 1.063 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -87.75 138.69 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.466 -179.868 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.719 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -175.5 125.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.321 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.767 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 53.1 mtpt -82.12 -171.7 3.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.797 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' SER . . . . . 1.062 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 2.2 m -139.6 19.87 2.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.305 0.574 . . . . 0.0 110.353 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.347 -1.252 . . . . 0.0 112.469 -179.884 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.492 ' HB3' ' H ' ' B' ' 2' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.849 0.356 . . . . 0.0 111.207 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.686 ' O ' ' HB2' ' B' ' 3' ' ' ASP . 0.4 OUTLIER -167.47 -160.64 0.37 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.864 179.958 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.686 ' HB2' ' O ' ' B' ' 2' ' ' CYS . 17.4 m-20 79.61 103.49 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.493 ' HB2' ' H ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 54.39 -98.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.973 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.666 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.2 OUTLIER 59.78 108.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.051 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.21 -168.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.633 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.78 HG12 ' HE2' ' B' ' 9' ' ' LYS . 10.5 t -157.03 73.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.901 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.853 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -38.16 150.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.78 ' HE2' HG12 ' B' ' 7' ' ' VAL . 63.2 mmtt -146.9 -3.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.485 ' O ' ' N ' ' B' ' 75' ' ' TYR . 2.5 t30 179.02 83.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.147 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.827 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -109.63 72.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.794 -179.151 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.766 ' HB2' ' HD2' ' B' ' 73' ' ' PHE . 0.6 OUTLIER -73.52 33.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.752 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.954 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -129.56 172.05 11.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.716 -178.782 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.872 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.98 133.21 32.83 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.94 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.987 ' HA ' HE21 ' B' ' 18' ' ' GLN . 3.2 mp0 -51.64 -69.43 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.408 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -52.21 -29.83 24.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.517 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.825 ' HG2' ' CG ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -75.17 -32.79 61.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.968 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.987 HE21 ' HA ' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -76.06 -28.59 57.69 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.854 0.359 . . . . 0.0 110.352 179.271 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.487 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 5.2 mm100 -72.87 -40.29 65.76 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.545 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 8.7 m-20 -68.33 -30.59 69.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.17 178.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -62.97 -48.7 77.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.976 178.97 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.954 HG22 ' CD2' ' B' ' 76' ' ' PHE . 95.5 t -55.25 -51.86 51.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.006 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 7.9 mt-10 -54.77 -36.34 64.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.862 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -36.18 70.41 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.657 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -70.65 -23.14 62.46 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.524 ' HA ' HD12 ' B' ' 29' ' ' LEU . 6.5 m -78.59 -42.2 29.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.599 178.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.78 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -54.04 -46.54 71.91 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.59 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.891 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -69.73 -36.77 76.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.005 178.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.655 HD11 ' HG ' ' B' ' 78' ' ' LEU . 5.8 mt -58.27 -53.0 63.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.026 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.608 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.78 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 11.0 mmmt -75.99 -25.68 56.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.3 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.513 ' CG ' ' C ' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -171.92 133.51 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.868 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -92.76 26.58 2.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.043 0.449 . . . . 0.0 110.601 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.662 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 42.8 mm -96.39 103.57 14.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.688 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 1.032 ' HG3' ' HA2' ' B' ' 59' ' ' GLY . 0.2 OUTLIER -30.05 -70.46 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.556 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -48.15 -53.77 15.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.806 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.662 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 18.3 t0 -48.77 -62.17 1.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.63 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.969 ' HB ' HG11 ' B' ' 58' ' ' VAL . 16.6 mt -44.12 -50.78 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.047 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.81 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -54.58 -47.54 73.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.984 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.828 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -60.01 -50.83 72.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.626 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.803 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.0 OUTLIER -52.9 -50.63 63.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.718 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.689 HD11 HG22 ' B' ' 38' ' ' ILE . 19.2 mt -59.97 -70.5 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.641 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.733 ' HD2' ' CE2' ' A' ' 65' ' ' TYR . 0.6 OUTLIER -38.54 -33.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.93 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.431 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 18.2 tttp -68.92 -60.45 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.034 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.764 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 3.0 mm-40 -62.29 -24.8 67.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.881 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -76.73 -38.81 53.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.605 179.759 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.608 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.6 OUTLIER -66.11 -35.59 80.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.714 179.791 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.505 ' HE2' ' HB3' ' B' ' 48' ' ' LYS . 3.0 mmmm -88.6 -32.51 18.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.764 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -76.35 -25.44 54.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.894 179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.702 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 26.0 m-85 -130.45 -68.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.702 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 1.4 t30 155.02 119.2 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.188 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.619 ' CB ' ' HA ' ' B' ' 53' ' ' THR . 20.7 Cg_endo -60.4 175.73 1.03 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.326 2.018 . . . . 0.0 112.346 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.901 HG21 ' CG2' ' A' ' 67' ' ' THR . 2.0 m -100.51 131.44 46.43 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.951 0.5 . . . . 0.0 110.547 0.04 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.818 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 64.6 m95 -103.14 100.86 10.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.007 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.74 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 20.5 m170 -73.45 94.37 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.077 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.982 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.5 OUTLIER -111.22 154.28 24.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.276 0.56 . . . . 0.0 112.148 -177.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.96 HG12 ' HA ' ' A' ' 64' ' ' SER . 29.9 mt -151.15 110.84 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.71 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 0.969 HG11 ' HB ' ' B' ' 38' ' ' ILE . 1.4 p -107.03 131.61 56.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.187 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 1.032 ' HA2' ' HG3' ' B' ' 35' ' ' GLU . . . -149.46 -134.06 2.28 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.842 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.429 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 1.5 ptm180 -161.51 1.66 0.06 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 120.704 0.288 . . . . 0.0 111.105 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.488 ' O ' ' CD ' ' A' ' 35' ' ' GLU . 1.2 t-20 174.55 34.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.162 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 1.009 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 54.8 p90 -90.48 174.48 7.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 0.0 110.76 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.626 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -123.02 74.17 0.39 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.035 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.889 ' HA ' HG23 ' A' ' 57' ' ' ILE . 28.4 p -74.35 102.76 4.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.879 0.371 . . . . 0.0 111.087 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.818 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 12.7 t80 -109.47 67.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.939 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.983 HG21 ' CE1' ' B' ' 86' ' ' PHE . 18.6 m -101.14 165.65 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.026 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.86 ' H ' ' CD2' ' A' ' 55' ' ' HIS . 2.3 m -115.15 95.52 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.973 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.631 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.0 OUTLIER -54.17 175.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.885 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.677 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.4 OUTLIER -168.76 80.02 0.14 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.977 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.65 HG23 ' H ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 163.62 -97.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.901 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.726 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -175.72 16.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.552 179.95 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.954 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 93.5 m-70 -126.93 69.47 1.27 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.864 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.0 t80 -128.83 75.33 1.63 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.507 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.827 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 1.2 tt -91.23 129.38 42.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.376 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.682 ' CD1' ' HB2' ' B' ' 84' ' ' LEU . 17.1 t80 -128.29 87.45 2.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.489 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.954 ' CD2' HG22 ' B' ' 22' ' ' VAL . 4.8 p90 -109.7 164.27 12.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.24 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.711 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 53.8 t80 -123.38 114.79 20.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.71 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.051 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.57 166.14 19.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.823 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.483 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -30.81 -36.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.66 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -151.33 30.73 0.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.914 0.388 . . . . 0.0 110.777 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.755 ' HB ' ' HB2' ' B' ' 78' ' ' LEU . 42.5 t -146.0 168.84 6.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.915 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.711 ' HB2' ' HD2' ' B' ' 77' ' ' TYR . . . -137.34 109.22 7.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.322 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.73 HD13 HG23 ' B' ' 58' ' ' VAL . 0.9 OUTLIER -101.25 133.78 43.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.239 0.542 . . . . 0.0 112.068 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.733 ' O ' HD12 ' B' ' 85' ' ' LEU . 0.1 OUTLIER -119.28 132.27 55.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.873 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.982 HD12 ' HB2' ' B' ' 56' ' ' CYS . 3.2 mp -137.35 101.5 4.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.983 ' CE1' HG21 ' B' ' 66' ' ' VAL . 12.5 p90 -139.61 123.87 17.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.97 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.805 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -91.8 159.18 15.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.677 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 1.3 m -117.64 19.95 13.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.31 0.576 . . . . 0.0 110.246 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.55 -179.891 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.917 0.389 . . . . 0.0 111.104 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -173.37 140.87 0.86 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.774 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.799 ' H ' HH21 ' A' ' 4' ' ' ARG . 47.3 m-20 -116.98 -129.94 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.799 HH21 ' H ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER 70.99 -94.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.748 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.565 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.6 OUTLIER 49.68 45.03 24.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.166 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.025 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -139.09 170.43 15.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.456 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 26.3 t -131.15 85.81 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.043 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.853 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -49.32 156.54 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.193 0.521 . . . . 0.0 110.826 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.74 ' HD3' ' O ' ' A' ' 8' ' ' ILE . 1.2 mmtp -144.78 -14.93 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.935 179.581 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -167.77 77.97 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.396 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.813 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -101.78 76.33 1.63 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.673 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.497 ' OD2' ' CD2' ' A' ' 68' ' ' HIS . 59.3 t0 -77.93 30.25 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.132 0.491 . . . . 0.0 109.973 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.922 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.4 OUTLIER -121.91 163.34 19.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 -179.481 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.841 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -50.13 128.43 19.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.976 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.771 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.3 mm-40 -37.83 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.022 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.797 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.9 OUTLIER -44.33 -31.1 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.922 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -70.94 -37.01 72.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.249 179.535 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.855 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -68.54 -30.29 69.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.475 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 6.3 pt20 -76.77 -38.3 54.34 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.44 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.4 -25.75 62.47 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.655 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.844 ' OG ' HG21 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -72.96 -50.66 22.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.106 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.855 HG23 ' O ' ' A' ' 18' ' ' GLN . 17.2 t -60.15 -38.27 76.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.528 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.716 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 47.5 mt-10 -67.15 -38.66 85.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.897 179.452 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.5 m -70.18 -34.77 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.606 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.845 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -72.52 -36.38 68.31 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.706 ' HA ' HD12 ' A' ' 29' ' ' LEU . 52.0 m -69.05 -36.5 77.75 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.565 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -61.5 -39.35 90.65 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.479 178.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.973 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -71.92 -28.75 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.604 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.845 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.2 mt -72.7 -41.39 65.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.81 -32.75 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.152 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HB3' ' CE2' ' A' ' 32' ' ' TYR . 1.2 mtpp -86.71 -26.59 24.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.043 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.603 ' HE1' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.18 178.18 10.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.746 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 1.062 ' HA ' HD11 ' A' ' 38' ' ' ILE . 9.6 p30 -158.39 40.19 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.02 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.006 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 42.0 mm -103.61 39.28 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.652 ' HB3' ' C ' ' B' ' 62' ' ' PHE . 4.5 mp0 43.33 -86.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.252 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.606 ' N ' ' O ' ' A' ' 34' ' ' ILE . 2.9 mtpt -48.82 -33.36 10.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.874 0.369 . . . . 0.0 110.228 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 1.006 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -65.88 -45.66 81.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.264 179.472 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 1.062 HD11 ' HA ' ' A' ' 33' ' ' ASN . 2.8 mp -65.1 -38.4 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.473 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.941 ' HB1' ' HB2' ' B' ' 65' ' ' TYR . . . -61.53 -43.13 99.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.424 179.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.739 ' HB2' ' CE1' ' B' ' 65' ' ' TYR . . . -62.38 -55.76 24.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.284 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.935 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.7 OUTLIER -47.81 -47.08 31.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.461 179.328 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.822 HG12 ' HA ' ' A' ' 25' ' ' ALA . 14.1 mt -67.18 -69.25 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.138 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.636 ' HG3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -43.42 -35.27 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.056 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.511 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -66.21 -62.19 1.62 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.821 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.641 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 13.5 mt-10 -52.98 -51.24 62.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.815 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -53.12 -52.14 59.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.79 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -57.43 -27.03 62.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.027 -179.876 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -113.94 9.61 17.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.147 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.641 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -121.73 -5.12 9.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.111 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.613 ' CD1' ' HA ' ' A' ' 46' ' ' PHE . 11.5 m-85 -148.56 -61.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.307 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.603 ' ND2' ' O ' ' A' ' 50' ' ' TYR . 1.3 p30 161.45 117.08 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.445 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.79 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 33.2 Cg_endo -64.23 167.21 15.0 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.449 2.099 . . . . 0.0 112.568 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.884 HG21 HG21 ' B' ' 67' ' ' THR . 4.9 t -109.54 122.28 47.07 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.757 0.423 . . . . 0.0 110.773 -0.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.703 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 28.4 m95 -89.7 135.86 33.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.841 -179.304 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.831 ' CE1' HG22 ' B' ' 67' ' ' THR . 0.0 OUTLIER -102.21 104.84 15.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.161 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.594 ' HB3' HD12 ' A' ' 85' ' ' LEU . 1.6 m -113.11 125.14 54.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.121 0.486 . . . . 0.0 112.171 -178.148 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.736 HG12 ' HA ' ' B' ' 64' ' ' SER . 13.4 mt -126.42 99.73 5.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.781 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.841 HG11 ' HB ' ' A' ' 38' ' ' ILE . 3.3 p -99.63 123.54 52.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.996 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.771 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -146.0 -150.69 5.25 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.171 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.751 HH11 ' HG3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -158.28 13.5 0.19 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.676 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 35.1 t30 174.08 35.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.449 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.933 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -100.06 157.78 16.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.152 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.91 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -114.73 83.75 0.34 Allowed Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.858 ' CB ' HD12 ' B' ' 57' ' ' ILE . 84.5 p -79.78 137.94 37.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.1 0.476 . . . . 0.0 111.75 -178.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.911 ' HB2' ' HB1' ' B' ' 39' ' ' ALA . 1.5 t80 -141.35 58.09 1.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.263 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.791 HG21 ' CE1' ' A' ' 86' ' ' PHE . 27.5 m -104.94 129.63 57.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.039 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.504 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 5.2 m -81.7 123.76 29.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.497 ' CD2' ' OD2' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -71.79 172.92 8.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.613 179.743 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.537 ' O ' ' HB ' ' A' ' 70' ' ' THR . 7.3 pt-20 -169.74 75.09 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.066 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.776 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 1.5 t 165.58 -104.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 70' ' ' THR . 17.3 mtmt -171.91 18.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.814 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.744 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 66.5 m-70 -130.56 67.47 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.707 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.689 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 1.8 t80 -133.16 93.42 3.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.597 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.844 HG21 ' OG ' ' A' ' 21' ' ' SER . 3.2 tt -108.96 122.69 64.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.323 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.759 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 34.9 t80 -116.11 88.51 2.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.453 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.853 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -113.3 168.85 9.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.934 0.397 . . . . 0.0 111.411 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.692 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 10.0 t80 -130.09 100.51 5.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.725 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.025 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.1 mm? -53.95 172.15 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -36.09 -36.57 0.14 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.689 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.522 ' O ' HG23 ' A' ' 81' ' ' VAL . 6.7 tp60 -151.5 41.23 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.915 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.656 HG13 ' O ' ' A' ' 59' ' ' GLY . 42.1 t -158.6 166.54 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.014 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.692 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -134.33 110.12 9.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.602 HD13 HG23 ' A' ' 58' ' ' VAL . 0.3 OUTLIER -99.71 118.1 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.038 0.447 . . . . 0.0 111.597 -179.28 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.759 ' HB2' ' CE1' ' A' ' 75' ' ' TYR . 1.6 tp -102.74 90.68 3.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.111 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.689 ' O ' ' HA ' ' A' ' 73' ' ' PHE . 0.6 OUTLIER -99.23 124.62 44.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.478 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.791 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.3 p90 -168.57 132.72 1.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.209 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.683 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -92.94 168.2 11.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.847 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.633 ' CB ' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -104.85 19.74 20.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.168 0.509 . . . . 0.0 110.826 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.393 -1.226 . . . . 0.0 112.481 -179.953 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.746 ' HA ' ' CE ' ' B' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.916 0.389 . . . . 0.0 111.219 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.475 ' C ' ' O ' ' B' ' 1' ' ' MET . 1.9 t -32.1 105.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.817 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' B' ' 5' ' ' LYS . 2.1 p30 -141.89 76.64 1.55 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.977 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.497 ' H ' ' HG2' ' B' ' 4' ' ' ARG . 0.3 OUTLIER -39.43 -28.14 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.505 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.675 ' HE3' ' H ' ' B' ' 6' ' ' ALA . 0.0 OUTLIER 57.42 -168.04 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.34 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.122 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 57.94 -178.34 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.514 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.757 ' O ' ' HD2' ' B' ' 9' ' ' LYS . 80.3 t -147.78 75.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.776 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.887 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -44.28 153.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.008 0.432 . . . . 0.0 110.211 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.767 ' HD2' ' HA ' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -135.29 -22.92 1.51 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.242 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.598 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 2.2 t-20 -145.74 -104.66 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.998 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.756 ' CB ' ' HA ' ' B' ' 74' ' ' ILE . . . 76.19 129.64 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.08 0.467 . . . . 0.0 112.091 178.828 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.711 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -124.49 35.22 4.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.169 179.094 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.695 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 23.0 ttp -121.28 158.2 28.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.962 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.707 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -38.87 158.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 179.747 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.69 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 13.1 mt-10 -67.17 -57.39 6.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.011 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.1 OUTLIER -55.75 -24.82 37.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.658 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.695 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -78.35 -43.53 27.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.856 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -60.75 -37.79 82.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.923 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.406 ' HG2' ' NE ' ' B' ' 4' ' ' ARG . 0.4 OUTLIER -74.74 -42.21 58.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.181 0.515 . . . . 0.0 109.907 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.64 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -65.19 -31.87 73.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.904 179.1 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.911 ' HB2' HD22 ' B' ' 85' ' ' LEU . 1.0 OUTLIER -66.01 -49.4 67.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.978 179.172 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.992 HG22 ' CD2' ' B' ' 76' ' ' PHE . 92.5 t -53.28 -46.52 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.672 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 5.0 mm-40 -61.94 -35.81 79.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.416 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.513 ' HB3' HG23 ' B' ' 42' ' ' ILE . 0.8 OUTLIER -70.48 -32.43 69.95 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.005 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.88 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.99 -40.59 68.45 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.659 ' HA ' HD12 ' B' ' 29' ' ' LEU . 85.2 m -64.94 -42.51 94.58 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.876 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.534 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 81.1 mt-30 -55.1 -46.84 75.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.853 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.885 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -63.45 -32.62 74.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.38 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.88 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.0 OUTLIER -68.51 -51.39 43.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.186 -179.778 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -33.25 71.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.969 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.421 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 13.1 mttt -82.88 -35.09 26.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.77 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.487 ' HE2' ' HB2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -146.64 150.87 36.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.737 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.661 ' C ' HD13 ' B' ' 34' ' ' ILE . 0.1 OUTLIER -114.97 32.05 6.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.007 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.967 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.1 mm -114.93 110.97 33.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.82 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.91 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 3.4 mp0 -29.99 -70.79 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.24 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.912 ' HE3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -46.23 -48.25 17.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.738 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.967 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -56.9 -62.16 1.94 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.631 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.885 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 4.2 mt -45.82 -45.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 1.069 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -59.35 -55.33 36.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.713 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.794 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -51.02 -45.07 61.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.667 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.845 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.5 t60 -59.1 -50.95 72.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.787 HG12 ' HA ' ' B' ' 25' ' ' ALA . 26.0 mt -60.71 -70.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.288 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.653 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 1.5 ttpt -37.19 -57.14 0.89 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.54 -44.67 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.087 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.2 OUTLIER -63.8 -33.72 76.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.759 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.761 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -74.67 -36.38 62.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.702 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.79 ' OD2' ' HB3' ' B' ' 52' ' ' PRO . 0.2 OUTLIER -68.82 -35.71 77.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.953 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.461 ' HE3' ' HB3' ' B' ' 48' ' ' LYS . 17.6 mmmt -90.75 -38.76 12.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.774 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.569 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.0 OUTLIER -77.79 -22.42 50.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.887 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.77 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 77.7 m-85 -120.61 -71.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.77 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.5 t-20 158.54 118.68 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.79 ' HB3' ' OD2' ' B' ' 47' ' ' ASP . 10.6 Cg_endo -53.3 167.21 0.86 Allowed 'Trans proline' 0 CA--C 1.534 0.484 0 C-N-CA 122.438 2.092 . . . . 0.0 112.791 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.64 HG22 ' NE2' ' B' ' 55' ' ' HIS . 16.3 m -104.68 131.37 52.19 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.774 0.43 . . . . 0.0 110.55 0.073 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.764 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 60.4 m95 -105.81 139.36 40.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.358 0.599 . . . . 0.0 111.884 -179.181 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.827 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.1 98.76 4.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.642 178.662 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.777 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 0.4 OUTLIER -119.87 162.03 19.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.453 0.644 . . . . 0.0 112.485 -177.795 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.881 ' HB ' ' HB3' ' B' ' 84' ' ' LEU . 20.0 mm -127.94 162.31 34.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.43 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.069 HG12 ' HB2' ' B' ' 39' ' ' ALA . 4.9 p -160.24 102.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.833 0.349 . . . . 0.0 111.331 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.833 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -136.73 -123.72 2.27 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.102 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -174.61 -46.15 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.787 0.327 . . . . 0.0 111.2 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m-20 -132.25 52.99 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.235 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.933 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -113.84 -154.08 0.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.909 0.385 . . . . 0.0 110.642 179.792 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.713 ' O ' ' HA ' ' A' ' 57' ' ' ILE . . . -154.53 103.84 0.24 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.676 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.736 ' HA ' HG12 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -96.2 137.9 34.6 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.121 0.486 . . . . 0.0 111.486 -179.205 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.941 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -143.83 51.71 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.157 179.6 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.698 HG12 ' HB3' ' A' ' 55' ' ' HIS . 4.5 m -99.6 139.9 20.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.44 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.884 HG21 HG21 ' A' ' 53' ' ' THR . 2.3 t -76.69 138.4 39.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.483 ' CD2' ' CB ' ' B' ' 12' ' ' ASP . 13.9 p-80 -110.81 159.04 18.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.58 176.71 12.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.657 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.651 ' C ' ' HG2' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 66.42 -92.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.976 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.651 ' HG2' ' C ' ' B' ' 70' ' ' THR . 0.9 OUTLIER 164.97 43.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.934 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.564 ' CG ' ' HD3' ' B' ' 87' ' ' LYS . 89.3 m-70 -134.32 46.86 2.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.717 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.711 ' HD1' ' H ' ' B' ' 12' ' ' ASP . 1.0 OUTLIER -126.94 139.93 52.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.525 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.856 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.5 OUTLIER -149.64 129.32 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.956 0.408 . . . . 0.0 111.595 179.819 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.732 ' HD1' HD12 ' B' ' 84' ' ' LEU . 8.5 t80 -114.2 133.54 55.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.986 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.992 ' CD2' HG22 ' B' ' 22' ' ' VAL . 0.2 OUTLIER -165.23 170.02 15.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.344 -179.506 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.693 ' OH ' ' HA ' ' B' ' 80' ' ' GLN . 5.8 t80 -132.67 116.7 16.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.042 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.122 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 3.7 mm? -69.91 167.04 18.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.553 ' O ' ' HG2' ' B' ' 80' ' ' GLN . . . -28.3 -37.23 0.01 OUTLIER Glycine 0 CA--C 1.519 0.296 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.949 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.693 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 5.3 mt-30 -154.42 38.8 0.44 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.727 0.299 . . . . 0.0 111.08 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.833 HG13 ' O ' ' B' ' 59' ' ' GLY . 53.2 t -158.32 167.9 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.111 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.98 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -124.36 160.45 28.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.662 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.98 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.0 OUTLIER -147.5 131.6 9.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 0.0 111.409 -179.583 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.881 ' HB3' ' HB ' ' B' ' 57' ' ' ILE . 4.0 tp -122.73 90.92 3.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.911 HD22 ' HB2' ' B' ' 21' ' ' SER . 0.9 OUTLIER -92.89 140.92 28.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.051 0.453 . . . . 0.0 111.682 -179.216 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.73 ' HZ ' ' HZ ' ' A' ' 86' ' ' PHE . 1.4 p90 -177.09 131.86 0.18 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.749 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.764 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.8 OUTLIER -96.73 158.65 15.33 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.56 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.827 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -103.17 19.22 19.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.235 0.54 . . . . 0.0 110.511 179.799 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.424 -179.986 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.858 0.361 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.453 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.0 p -149.63 115.52 5.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 4' ' ' ARG . 3.1 t70 -98.47 -38.01 9.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.968 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.437 ' HB2' ' O ' ' A' ' 3' ' ' ASP . 4.7 mtp180 64.83 35.3 8.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.526 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.729 ' O ' HD13 ' A' ' 78' ' ' LEU . 15.3 tppt? -37.69 122.49 0.96 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.936 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.028 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 156.21 156.95 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.719 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.49 ' C ' ' H ' ' A' ' 77' ' ' TYR . 58.0 t -123.38 78.85 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.006 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.866 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -48.85 164.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.171 0.51 . . . . 0.0 110.636 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.743 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -163.16 -13.47 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.975 179.733 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.572 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -164.52 89.12 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.32 179.863 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.852 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -126.03 93.43 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.715 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 73' ' ' PHE . 9.1 t70 -85.15 28.98 0.68 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.906 179.007 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.758 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 34.6 ttp -120.28 157.67 28.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.983 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.79 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 2.3 m -41.32 147.36 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.556 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.773 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.9 OUTLIER -54.89 -56.29 21.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.248 -179.69 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.9 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.2 OUTLIER -62.29 -27.59 69.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.944 0.402 . . . . 0.0 110.251 179.78 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.76 ' HA ' ' OD2' ' A' ' 20' ' ' ASP . 39.7 mmm -71.29 -30.82 66.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.498 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.956 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -79.25 -29.03 42.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.212 179.327 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.9 ' HG2' ' HA ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -77.53 -43.95 30.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.652 179.165 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.76 ' OD2' ' HA ' ' A' ' 17' ' ' MET . 4.9 p30 -70.86 -31.05 67.62 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.492 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.771 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.3 t -65.14 -46.26 81.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.041 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.821 HG22 ' CD2' ' A' ' 76' ' ' PHE . 53.0 t -59.51 -46.87 92.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.088 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.705 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 28.7 mt-10 -56.46 -34.25 66.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.863 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.624 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 49.8 t -71.46 -36.53 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.076 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.765 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -71.78 -30.78 65.91 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.65 ' HA ' HD12 ' A' ' 29' ' ' LEU . 27.8 m -71.92 -37.99 69.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.252 -1.34 . . . . 0.0 109.429 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.817 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.7 OUTLIER -59.69 -44.41 93.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.608 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.979 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -71.91 -25.61 61.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.838 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.711 HD12 ' O ' ' A' ' 25' ' ' ALA . 3.0 mt -72.82 -45.73 56.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.148 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -77.83 -21.88 50.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.817 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 23.9 mmtt -90.04 -26.47 20.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.084 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -166.98 115.22 0.83 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.949 -179.844 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.47 ' OD1' ' O ' ' A' ' 29' ' ' LEU . 28.9 m-20 -81.54 32.79 0.35 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.087 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.816 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 39.7 mm -102.62 101.68 12.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.101 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.515 ' C ' ' O ' ' A' ' 34' ' ' ILE . 1.8 mp0 -24.15 -86.96 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.408 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -40.03 -37.11 0.55 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.754 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.816 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -63.15 -62.19 1.87 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.645 179.811 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.979 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 20.8 mt -47.34 -44.22 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.661 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 1.038 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -58.22 -46.98 84.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.483 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.802 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -57.97 -61.09 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.325 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.843 ' CG ' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -40.98 -58.6 1.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.607 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.991 HG21 HD11 ' A' ' 85' ' ' LEU . 6.1 mt -52.22 -70.94 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.747 ' C ' ' HD2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -38.17 -54.84 1.35 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.031 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.31 -62.74 1.28 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.042 0.448 . . . . 0.0 110.963 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.76 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -52.11 -50.7 61.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.152 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.771 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -57.81 -35.67 71.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.777 ' HA ' ' HD1' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -74.13 -21.16 59.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -122.39 13.38 10.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.331 -179.728 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.76 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -129.37 6.35 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.39 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CD2' ' CD1' ' A' ' 46' ' ' PHE . 97.2 m-85 -148.61 -65.65 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 0.0 111.225 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.453 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 2.6 t-20 163.34 102.83 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.733 ' HA ' ' OD1' ' A' ' 47' ' ' ASP . 45.8 Cg_exo -36.87 154.49 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.665 2.243 . . . . 0.0 112.711 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.814 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 25.9 m -114.44 140.86 48.36 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.047 0.539 . . . . 0.0 110.369 -0.082 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.777 ' HD1' ' HA ' ' A' ' 47' ' ' ASP . 76.9 m95 -105.62 145.09 31.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.527 0.68 . . . . 0.0 112.422 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.919 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 4.5 m-70 -136.18 101.66 4.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.819 179.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.838 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.76 165.74 14.15 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.796 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.036 HG13 HD23 ' A' ' 84' ' ' LEU . 17.8 mm -133.86 169.66 21.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.22 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.038 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.0 p -166.13 117.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.78 0.324 . . . . 0.0 111.475 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.624 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -151.08 -154.41 6.52 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.06 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.754 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -157.54 32.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.759 0.314 . . . . 0.0 111.388 -179.757 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.754 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 14.0 t-20 163.94 29.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.74 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.833 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.0 OUTLIER -106.6 172.89 6.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.312 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.831 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.2 94.51 0.43 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.921 ' HB2' HD22 ' A' ' 84' ' ' LEU . 69.6 p -82.01 123.61 29.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 111.693 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.927 ' H ' HD13 ' B' ' 57' ' ' ILE . 5.0 t80 -135.11 64.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.16 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.939 HG13 HD11 ' B' ' 57' ' ' ILE . 26.7 m -101.75 148.11 7.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.145 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.774 HG21 HG21 ' B' ' 53' ' ' THR . 5.4 m -91.14 76.05 6.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.509 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 50.8 p-80 -55.1 169.69 0.23 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.463 ' C ' ' OG1' ' A' ' 70' ' ' THR . 0.5 OUTLIER -151.73 169.4 22.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.864 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.463 ' OG1' ' C ' ' A' ' 69' ' ' GLU . 0.3 OUTLIER 78.18 -101.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.052 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.673 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 179.03 28.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 1.092 ' HB2' ' HG3' ' A' ' 87' ' ' LYS . 32.6 m-70 -126.95 52.78 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.886 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 2.9 t80 -126.29 114.99 19.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.157 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.956 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.3 tt -126.4 137.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.895 0.379 . . . . 0.0 111.555 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.572 ' N ' ' O ' ' A' ' 10' ' ' ASN . 38.4 t80 -126.65 116.39 20.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.213 179.146 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.866 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -139.02 163.29 32.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.004 0.431 . . . . 0.0 111.456 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.627 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 25.8 t80 -121.17 93.41 4.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.499 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.028 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.3 mm? -43.78 172.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.645 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.488 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.82 -39.61 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.584 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.544 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.6 OUTLIER -153.52 21.55 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.956 0.408 . . . . 0.0 110.767 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.79 HG12 ' H ' ' A' ' 82' ' ' ALA . 28.5 t -134.91 177.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.898 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.996 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -137.95 153.33 49.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.805 0.336 . . . . 0.0 110.857 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.996 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.4 OUTLIER -143.49 120.91 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.254 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.036 HD23 HG13 ' A' ' 57' ' ' ILE . 13.2 tp -104.6 90.51 3.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.482 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.991 HD11 HG21 ' A' ' 42' ' ' ILE . 0.3 OUTLIER -95.47 141.92 28.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.648 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.886 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 47.0 p90 177.48 138.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.698 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 1.092 ' HG3' ' HB2' ' A' ' 72' ' ' HIS . 8.0 mtmt -97.44 174.11 6.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.66 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.919 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.2 OUTLIER -126.99 16.84 7.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.309 0.576 . . . . 0.0 110.534 179.45 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 CA-C-O 118.364 -1.242 . . . . 0.0 112.558 179.945 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 75.2 mmm . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.784 0.326 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.685 ' O ' HG21 ' B' ' 26' ' ' THR . 0.0 OUTLIER -154.47 -88.49 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.993 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.411 ' H ' ' HB3' ' B' ' 2' ' ' CYS . 0.4 OUTLIER -58.61 145.53 39.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.834 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.641 HH11 ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER 62.75 -97.44 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.72 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.584 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 49.61 30.46 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.07 179.93 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.041 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -124.99 -166.89 1.59 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.145 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.526 ' N ' ' O ' ' B' ' 77' ' ' TYR . 57.8 t -151.18 73.84 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.957 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.955 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -41.04 159.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.093 0.473 . . . . 0.0 110.826 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.761 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 0.2 OUTLIER -155.04 -10.57 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.511 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.573 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.0 OUTLIER -164.6 84.79 0.42 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.34 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.821 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -123.53 88.99 3.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.881 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.611 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 10.8 t0 -87.6 25.35 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.26 0.552 . . . . 0.0 109.959 179.189 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.896 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.1 OUTLIER -110.96 166.84 10.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.656 -179.723 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.893 ' N ' ' HG2' ' B' ' 13' ' ' MET . 23.2 t -50.07 120.34 4.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.769 0.319 . . . . 0.0 110.731 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.877 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 3.2 mp0 -32.95 -67.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.178 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.459 ' H ' ' HG2' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -46.93 -44.99 20.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.674 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.896 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 31.7 mmm -61.23 -32.08 71.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.93 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -68.35 -43.16 78.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.878 179.87 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.488 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 2.9 mp0 -69.36 -33.87 73.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -71.4 -33.26 69.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.966 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.813 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.6 OUTLIER -67.94 -40.74 83.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.22 179.435 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.812 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 10.7 t -62.97 -46.12 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.376 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.593 ' HG2' ' H ' ' B' ' 4' ' ' ARG . 29.8 mt-10 -62.58 -32.33 73.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.894 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.43 ' SG ' ' HD1' ' B' ' 46' ' ' PHE . 4.9 t -73.45 -36.44 65.9 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.908 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.956 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -69.27 -36.54 77.21 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.685 HG21 ' O ' ' B' ' 2' ' ' CYS . 87.5 m -64.76 -42.79 94.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.618 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.631 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 12.8 mm100 -52.63 -48.67 66.22 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.803 179.093 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.812 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -59.83 -43.83 94.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.359 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.956 HD12 ' O ' ' B' ' 25' ' ' ALA . 0.9 OUTLIER -59.56 -60.57 3.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.806 179.824 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -48.57 -33.74 10.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.995 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 0.0 OUTLIER -85.28 -27.73 25.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.39 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.571 ' HE2' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -155.12 150.82 27.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.831 0.348 . . . . 0.0 111.226 -179.202 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.518 ' O ' HD13 ' B' ' 34' ' ' ILE . 35.6 t30 -115.36 47.07 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.95 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.887 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 42.0 mm -126.08 108.56 19.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.864 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.831 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 26.7 mp0 -29.53 -70.85 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.133 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.23 -49.11 61.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.766 0.317 . . . . 0.0 110.741 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.887 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.8 t0 -53.22 -64.27 0.87 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.862 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.842 HG21 ' HG ' ' B' ' 29' ' ' LEU . 11.6 mt -48.9 -43.74 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.691 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.98 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.32 -46.71 76.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.468 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.809 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -61.42 -67.27 0.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.496 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.797 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.7 OUTLIER -34.15 -40.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.538 179.44 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.868 HG21 HD11 ' B' ' 85' ' ' LEU . 33.9 mt -67.33 -50.91 58.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.298 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.712 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 6.1 tttt -55.33 -46.88 76.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.174 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -67.24 -36.83 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.209 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.596 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 8.5 mm-40 -68.45 -44.8 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.905 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.813 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -67.37 -35.27 79.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.678 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.833 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -66.79 -38.77 87.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.221 179.763 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.994 ' HE3' ' HA ' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.66 -18.21 25.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.111 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.649 ' HB3' ' HZ2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -88.75 -29.58 19.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.383 -179.573 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.624 ' HE2' ' CD1' ' B' ' 46' ' ' PHE . 7.0 m-85 -131.74 -57.16 0.99 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.533 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.606 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 27.4 t-20 157.23 119.36 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.11 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.418 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.833 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 20.3 Cg_endo -59.77 170.72 3.31 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.558 2.172 . . . . 0.0 112.255 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.774 HG21 HG21 ' A' ' 67' ' ' THR . 4.4 m -106.85 129.47 54.69 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 123.154 0.582 . . . . 0.0 110.475 0.136 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.714 ' CD2' ' HD2' ' B' ' 87' ' ' LYS . 58.0 m95 -101.74 116.81 33.54 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.83 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.0 OUTLIER -93.69 100.14 12.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.286 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.74 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.0 OUTLIER -108.54 148.62 30.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.305 0.574 . . . . 0.0 112.457 -178.005 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.978 ' CG1' HD23 ' B' ' 84' ' ' LEU . 19.5 mm -133.6 103.7 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.376 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 0.98 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.4 p -105.87 117.78 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.398 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.852 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -132.43 -104.88 0.94 Allowed Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.177 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.572 ' HD3' ' CG ' ' A' ' 61' ' ' ASN . 1.0 OUTLIER 179.67 -17.71 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.777 0.323 . . . . 0.0 111.131 -179.778 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.469 ' CG ' ' O ' ' B' ' 60' ' ' ARG . 22.0 m-20 177.78 41.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.833 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 27.6 p90 -87.61 -167.71 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -131.41 86.6 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.19 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.954 ' HA ' HG23 ' A' ' 57' ' ' ILE . 5.5 p -83.3 119.01 24.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 0.0 111.315 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.802 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 22.9 t80 -127.28 73.35 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.367 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.761 HG21 ' CE1' ' B' ' 86' ' ' PHE . 21.1 m -125.15 156.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.404 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.76 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 20.7 m -84.99 145.99 27.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.756 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.743 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -97.5 173.44 7.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.925 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.722 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 1.3 mm-40 -138.59 -114.92 0.15 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.12 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.582 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -47.29 -103.45 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.066 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.669 ' O ' ' HB2' ' B' ' 72' ' ' HIS . 1.3 mmtt -55.45 0.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.769 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 2.1 m170 76.77 -89.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.622 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.769 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 3.8 p90 163.46 155.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.986 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.93 HD12 ' CA ' ' B' ' 18' ' ' GLN . 1.1 tt -129.6 130.65 67.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.204 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.688 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -113.57 132.32 55.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.056 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.955 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.4 OUTLIER -158.21 152.54 24.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.966 0.412 . . . . 0.0 111.373 -179.45 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.582 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 1.0 OUTLIER -119.74 112.02 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.759 179.7 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.041 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -71.11 170.61 12.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.598 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.507 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.19 -55.93 0.06 OUTLIER Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.94 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -139.54 35.89 2.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.797 0.332 . . . . 0.0 111.035 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.852 HG13 ' O ' ' B' ' 59' ' ' GLY . 92.2 t -151.05 170.19 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 1.014 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -130.18 157.73 41.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.652 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 1.014 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -146.18 133.3 14.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.906 0.384 . . . . 0.0 111.537 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.978 HD23 ' CG1' ' B' ' 57' ' ' ILE . 0.5 OUTLIER -126.87 90.59 3.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.004 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.868 HD11 HG21 ' B' ' 42' ' ' ILE . 0.3 OUTLIER -90.74 130.74 36.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -178.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.761 ' CE1' HG21 ' B' ' 66' ' ' VAL . 1.6 p90 -169.15 120.97 0.75 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.833 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.745 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -87.67 162.99 16.79 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.909 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.83 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 3.0 m -115.87 19.25 15.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.184 0.516 . . . . 0.0 110.89 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.425 -1.208 . . . . 0.0 112.581 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.518 ' HA ' HH12 ' A' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.851 0.357 . . . . 0.0 111.204 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 172.98 -35.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.758 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -130.51 -1.53 4.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.603 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.787 ' HB2' HH11 ' A' ' 4' ' ' ARG . 0.0 OUTLIER -63.09 -47.3 83.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.953 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.8 tttp 43.89 -162.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.121 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 59.41 175.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.34 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.741 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 3.8 t -144.59 73.05 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.546 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.993 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -43.24 130.2 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.883 0.373 . . . . 0.0 110.104 179.578 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.781 ' HE3' ' HB3' ' A' ' 77' ' ' TYR . 2.4 mmtp -120.91 -12.56 8.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.631 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.645 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 2.6 t30 -149.78 -92.1 0.07 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.383 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.883 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 67.21 -163.79 0.22 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.772 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.606 ' N ' ' O ' ' A' ' 73' ' ' PHE . 3.5 t0 169.34 31.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.967 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.891 ' SD ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -106.07 160.34 15.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.146 -179.439 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.573 ' O ' ' N ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -65.78 72.26 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.709 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 3.4 mt-10 32.92 -88.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.213 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 14' ' ' SER . 6.3 pt-20 -31.36 -32.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.108 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.741 ' HG3' ' CB ' ' A' ' 13' ' ' MET . 6.4 tpp -75.02 -45.53 41.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.054 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.759 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -63.22 -29.28 70.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 0.0 110.831 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.643 ' OE1' ' HG3' ' A' ' 4' ' ' ARG . 74.1 mm-40 -76.92 -45.07 29.22 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.76 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -68.68 -30.9 69.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.803 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.817 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.9 OUTLIER -64.55 -48.16 76.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.678 178.988 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.8 HG22 ' CD2' ' A' ' 76' ' ' PHE . 55.7 t -55.56 -50.48 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.183 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -52.88 -37.96 61.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.382 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.673 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 76.5 m -68.93 -36.85 78.46 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.147 0.499 . . . . 0.0 110.185 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.747 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.66 -30.06 67.65 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.771 ' HA ' HD12 ' A' ' 29' ' ' LEU . 94.8 m -74.08 -43.29 58.22 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.103 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.827 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.9 OUTLIER -52.66 -44.16 66.0 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.075 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 1.004 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -75.47 -26.58 58.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.205 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.921 HD11 ' HG ' ' A' ' 78' ' ' LEU . 3.6 mt -67.72 -44.93 76.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.374 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -81.0 -28.98 35.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.053 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.562 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.6 OUTLIER -77.43 -31.04 53.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.972 0.415 . . . . 0.0 110.92 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.642 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -160.82 138.86 9.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.511 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.638 ' HA ' HD11 ' A' ' 38' ' ' ILE . 2.6 m120 -100.97 27.84 5.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 0.0 110.627 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 50.4 mm -99.63 91.62 2.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.966 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.744 ' HG2' ' HA2' ' A' ' 59' ' ' GLY . 4.1 mp0 -23.25 -78.93 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.144 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.69 ' HD2' ' CG2' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.42 -42.3 3.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.899 179.725 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.77 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.3 t0 -63.61 -60.73 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.993 0.425 . . . . 0.0 110.583 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 1.004 HG23 ' HB3' ' A' ' 28' ' ' ALA . 41.0 mt -47.97 -40.23 8.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.409 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.999 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -69.31 -41.78 76.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.39 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.75 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -54.39 -57.46 11.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.225 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.623 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -59.17 -57.32 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.98 -179.874 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.747 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 91.8 mt -38.67 -45.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.337 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.729 ' HD3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -68.3 -59.61 3.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.019 -179.77 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.445 ' O ' ' OD2' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -43.76 -51.23 7.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.294 -179.656 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 5.0 tt0 -65.74 -49.31 68.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.991 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.817 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -58.21 -27.98 64.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.744 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -81.01 -34.11 33.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HE3' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -98.75 5.95 47.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.125 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -126.44 -5.69 6.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.871 179.922 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.76 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 53.8 m-85 -136.82 -63.93 0.6 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.065 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.684 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 47.1 t30 160.82 110.59 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.38 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.744 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 35.1 Cg_exo -58.38 157.69 25.55 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.433 2.088 . . . . 0.0 112.478 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.96 HG23 ' CE1' ' A' ' 55' ' ' HIS . 11.1 t -108.84 139.0 44.27 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.932 0.493 . . . . 0.0 110.49 -0.101 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.828 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 62.2 m95 -101.9 121.14 41.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.2 0.524 . . . . 0.0 112.193 -178.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.96 ' CE1' HG23 ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.36 93.71 5.11 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.436 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.917 ' O ' HD13 ' A' ' 57' ' ' ILE . 1.6 p -112.78 161.7 16.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.323 0.583 . . . . 0.0 112.489 -178.008 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.964 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 21.9 mm -134.15 159.01 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.036 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.999 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.3 p -157.59 107.7 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.881 0.372 . . . . 0.0 111.531 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.744 ' HA2' ' HG2' ' A' ' 35' ' ' GLU . . . -143.58 -153.67 5.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.207 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.697 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.68 28.5 0.1 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.628 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.697 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 2.2 t-20 167.94 27.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.458 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.973 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -98.54 -157.24 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.978 179.721 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.584 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -154.85 81.17 0.17 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.118 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.799 ' HA ' HG12 ' B' ' 57' ' ' ILE . 74.0 p -66.69 161.2 23.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.012 0.435 . . . . 0.0 111.326 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.764 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 63.3 t80 -167.8 45.32 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.484 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.806 HG21 ' CE1' ' A' ' 86' ' ' PHE . 3.5 m -97.56 152.44 4.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.872 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.844 HG22 ' NE2' ' B' ' 55' ' ' HIS . 1.0 OUTLIER -96.96 147.96 23.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.995 -179.778 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.508 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -97.74 169.81 9.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.687 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.646 ' O ' HG23 ' A' ' 70' ' ' THR . 2.6 pt-20 -170.31 69.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.106 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.646 HG23 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 167.24 -110.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.231 179.822 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.706 ' O ' ' HA ' ' A' ' 13' ' ' MET . 20.5 pttm -162.19 6.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.662 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.845 ' HB2' ' HD3' ' A' ' 87' ' ' LYS . 0.9 OUTLIER -117.35 61.88 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.949 -179.981 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.724 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.3 t80 -133.69 94.77 3.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.746 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.891 ' HB ' ' SD ' ' A' ' 13' ' ' MET . 2.4 tt -110.18 134.82 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.304 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.645 ' HB3' ' HB3' ' A' ' 10' ' ' ASN . 3.4 t80 -127.15 88.86 2.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.231 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.993 ' HB3' HG13 ' A' ' 8' ' ' ILE . 3.1 p90 -114.86 174.35 6.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.36 -179.309 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.781 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 24.2 t80 -130.61 105.23 7.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.749 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.3 mm? -55.05 163.99 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.912 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.478 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.27 -47.38 0.18 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.54 20.09 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.709 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.782 HG12 ' H ' ' A' ' 82' ' ' ALA . 28.3 t -139.19 177.4 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.705 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.984 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -138.24 151.15 47.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.55 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.984 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.3 OUTLIER -141.89 122.04 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.957 0.408 . . . . 0.0 111.039 -179.696 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.964 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 4.7 tp -109.82 85.05 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.676 ' HG ' ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -87.84 137.91 31.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.806 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.6 p90 -179.26 132.01 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.373 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.845 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 1.2 mtpm? -102.49 -157.68 0.62 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.59 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -156.47 20.53 0.35 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.319 0.58 . . . . 0.0 110.569 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.336 -1.258 . . . . 0.0 112.453 -179.962 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.408 ' HB3' ' H ' ' B' ' 2' ' ' CYS . 1.7 mtt . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.822 0.344 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.411 ' O ' ' SG ' ' B' ' 2' ' ' CYS . 1.2 p -103.21 128.66 50.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.026 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -141.79 -166.02 2.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.877 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.502 ' H ' ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -101.54 -54.67 2.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.84 179.986 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 49.12 29.45 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.917 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.073 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -123.78 -168.3 1.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.302 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.641 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 40.2 t -153.46 76.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.209 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.771 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.4 mp -35.04 146.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.538 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.912 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 8.8 mmpt? -121.74 -23.39 5.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.376 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.422 ' HB3' ' H ' ' B' ' 11' ' ' ALA . 0.9 OUTLIER -153.11 -86.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.334 179.814 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.8 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 59.05 120.49 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.672 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.653 ' HB2' ' CE1' ' B' ' 73' ' ' PHE . 0.5 OUTLIER -117.75 25.12 10.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.261 0.553 . . . . 0.0 110.263 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.836 ' H ' HE22 ' B' ' 18' ' ' GLN . 14.0 ttp -108.45 169.78 8.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.756 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.718 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.8 OUTLIER -52.51 132.88 35.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.798 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.527 ' H ' ' HG3' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -42.73 -65.96 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.902 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -43.86 -34.12 1.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.807 ' SD ' ' HD3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -73.49 -32.72 64.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.942 ' O ' HG23 ' B' ' 22' ' ' VAL . 0.9 OUTLIER -68.48 -37.58 80.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.89 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.643 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -73.62 -38.35 65.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.35 -35.07 71.04 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.657 -0.702 . . . . 0.0 109.759 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.822 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -63.66 -40.82 97.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.844 179.131 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.942 HG23 ' O ' ' B' ' 18' ' ' GLN . 27.5 t -63.57 -44.6 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.304 179.312 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.643 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 51.5 mt-10 -57.59 -38.73 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.424 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.904 ' HB3' HG23 ' B' ' 42' ' ' ILE . 0.0 OUTLIER -67.82 -36.62 80.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.318 179.53 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.869 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.7 -30.08 65.28 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.424 ' HA ' HD12 ' B' ' 29' ' ' LEU . 11.4 m -73.29 -39.24 65.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.619 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.846 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -57.74 -43.7 85.56 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.404 178.826 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 1.008 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -68.8 -37.86 79.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.181 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.869 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -63.33 -39.5 94.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.779 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.16 -23.36 38.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.919 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.746 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -86.8 -25.36 24.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.811 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.6 ' CE1' ' HB3' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -157.63 175.1 14.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -133.62 38.4 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.081 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.918 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 5.0 mm -121.4 106.16 17.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.67 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.689 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 3.2 mp0 -29.52 -70.5 0.05 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.937 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.443 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.87 -37.84 14.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.622 179.603 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.918 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 20.0 t0 -66.92 -60.26 2.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 1.059 ' HB ' HG11 ' B' ' 58' ' ' VAL . 4.3 mt -47.71 -47.34 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.769 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.937 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.66 -50.37 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.636 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.764 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -56.44 -62.1 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.56 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.846 ' NE2' ' HB3' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -36.18 -55.02 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.234 179.436 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.904 HG23 ' HB3' ' B' ' 24' ' ' CYS . 16.3 mt -51.39 -69.98 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.089 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.827 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.0 OUTLIER -34.94 -63.34 0.32 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.414 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 0.3 OUTLIER -46.21 -41.63 13.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.114 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.783 ' HB3' ' SG ' ' B' ' 24' ' ' CYS . 2.0 tp10 -69.36 -44.16 72.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.89 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.822 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -65.9 -29.86 70.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.929 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.935 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.63 -40.56 66.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.693 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.528 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.12 -17.97 26.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.052 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.742 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.6 OUTLIER -88.34 -36.42 16.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.763 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.689 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 2.1 m-85 -123.46 -57.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.101 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.689 ' HB3' ' O ' ' B' ' 50' ' ' TYR . 5.9 p30 154.3 119.62 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.105 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.747 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.935 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 19.2 Cg_endo -59.09 168.49 4.56 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.254 1.969 . . . . 0.0 112.556 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.839 HG21 HG21 ' A' ' 67' ' ' THR . 1.2 t -112.7 119.16 37.13 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 122.726 0.41 . . . . 0.0 111.001 0.035 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.788 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 26.6 m95 -91.2 113.74 26.08 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.38 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.952 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 23.4 m170 -72.55 116.13 12.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.827 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 3.6 m -114.95 135.8 53.82 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.278 0.561 . . . . 0.0 112.438 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.799 HG12 ' HA ' ' A' ' 64' ' ' SER . 13.7 mt -139.98 104.92 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.02 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.059 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.8 p -112.52 125.81 69.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.684 -179.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.759 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -146.14 -131.33 2.25 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.682 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -165.69 -0.34 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 120.774 0.321 . . . . 0.0 111.091 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -173.96 34.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.973 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.8 p90 -93.67 163.42 13.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.675 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.726 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -118.15 80.27 0.31 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.815 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.91 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.0 p -77.9 128.02 33.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 111.368 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.75 ' CG ' ' HA ' ' A' ' 40' ' ' ALA . 25.2 t80 -136.85 68.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.348 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.887 HG13 HD11 ' A' ' 57' ' ' ILE . 29.8 m -111.58 151.81 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.107 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.918 HG21 HG21 ' A' ' 53' ' ' THR . 3.7 t -80.97 120.12 24.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.885 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.713 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -60.0 157.27 13.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.582 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 2.3 mt-10 -148.77 151.85 35.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.97 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.782 HG22 ' N ' ' B' ' 71' ' ' LYS . 42.2 m 57.63 -107.64 0.38 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.556 -179.676 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.807 ' HD3' ' SD ' ' B' ' 17' ' ' MET . 26.7 mttp -72.2 8.29 1.37 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.433 . . . . 0.0 110.375 179.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.772 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 24.8 m-70 79.6 -86.78 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.431 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.772 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 160.91 -175.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.745 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.898 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -158.13 117.58 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.099 179.626 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.82 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 13.2 t80 -108.15 139.21 43.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.605 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.807 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 1.3 p90 -160.32 169.98 22.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.608 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.636 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 23.5 t80 -132.02 113.83 13.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.073 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.4 mm? -70.93 169.43 14.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.781 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.51 -51.82 0.05 OUTLIER Glycine 0 C--N 1.333 0.372 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.845 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.468 ' O ' HG23 ' B' ' 81' ' ' VAL . 20.2 tt0 -143.25 41.61 1.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.81 0.338 . . . . 0.0 110.405 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.759 HG13 ' O ' ' B' ' 59' ' ' GLY . 60.4 t -157.9 169.9 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.189 -179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.653 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -135.12 141.74 46.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.329 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.825 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.2 OUTLIER -128.79 130.53 68.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.085 0.469 . . . . 0.0 111.939 -179.416 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.679 HD23 ' HB ' ' B' ' 57' ' ' ILE . 0.4 OUTLIER -117.33 97.88 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.791 HD11 HG21 ' B' ' 42' ' ' ILE . 1.2 mp -101.09 112.43 24.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.403 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.771 ' CE1' HG21 ' B' ' 66' ' ' VAL . 6.7 p90 -149.71 128.8 12.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.752 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.788 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 42.4 mtpt -93.4 170.12 9.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.296 -179.581 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.952 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -119.2 19.27 12.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.638 179.728 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.459 -1.189 . . . . 0.0 112.544 -179.976 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.815 0.341 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 36.1 m -63.07 -14.69 51.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.03 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.796 ' HB3' ' NH2' ' A' ' 4' ' ' ARG . 14.3 m-20 71.37 98.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.881 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.796 ' NH2' ' HB3' ' A' ' 3' ' ' ASP . 0.0 OUTLIER 80.67 88.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.915 ' O ' HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -54.53 -170.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.859 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.101 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 81.47 152.29 0.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.437 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.629 HG12 ' O ' ' A' ' 7' ' ' VAL . 55.5 t -113.89 74.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.809 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.857 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -39.01 158.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.668 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -151.69 -8.92 0.22 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.764 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.538 ' O ' ' N ' ' A' ' 75' ' ' TYR . 1.3 m-20 -172.95 92.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.41 180.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.825 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -128.76 77.04 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.786 -179.509 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.57 ' HB3' ' HB3' ' A' ' 72' ' ' HIS . 0.2 OUTLIER -73.72 26.94 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.064 179.104 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.873 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -111.84 171.24 7.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.564 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.873 ' N ' ' HG2' ' A' ' 13' ' ' MET . 18.9 m -56.47 151.56 13.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.767 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.689 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -56.26 -65.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.956 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.743 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -51.39 -25.23 5.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.768 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 68.1 mmm -78.77 -36.23 43.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.061 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 1.049 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -73.34 -36.81 66.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.733 ' CB ' ' HG2' ' A' ' 4' ' ' ARG . 37.0 mt-30 -74.74 -36.33 62.64 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.743 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -73.02 -31.72 64.65 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.678 178.918 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.79 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -64.77 -46.18 83.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.835 179.142 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.915 HG11 ' O ' ' A' ' 5' ' ' LYS . 97.2 t -60.06 -50.66 79.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.405 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.702 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 6.5 mt-10 -52.97 -37.94 61.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.364 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.19 -40.27 93.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.135 0.493 . . . . 0.0 110.056 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.799 ' C ' HD12 ' A' ' 29' ' ' LEU . . . -68.42 -33.39 74.14 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.728 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -71.51 -35.97 70.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.748 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.575 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 6.0 mt-30 -57.4 -42.96 83.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.373 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.998 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -85.93 -24.16 26.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 1.032 HD13 ' HG ' ' A' ' 78' ' ' LEU . 4.7 mt -75.51 -26.35 58.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.728 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.47 -35.27 11.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.607 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.575 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -83.96 -8.59 59.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.321 179.541 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.715 ' CE1' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -154.17 -174.57 5.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.791 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -154.57 26.2 0.45 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.569 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.083 ' HB ' ' HB3' ' A' ' 37' ' ' ASP . 11.5 mm -116.01 102.24 13.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.836 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.853 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 4.5 mp0 -25.28 -78.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.183 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.793 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -41.56 -46.24 3.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.703 179.63 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 1.083 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -58.03 -60.04 4.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.779 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.998 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 2.1 mt -48.61 -46.92 15.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.839 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 1.039 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.92 -53.14 61.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.04 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.691 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -42.16 -56.65 2.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.715 ' CD2' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -59.69 -57.04 14.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.907 -179.974 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.752 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 56.5 mt -42.9 -68.13 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.14 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.746 ' HB3' ' CD2' ' B' ' 65' ' ' TYR . 1.5 tmtt? -50.9 -34.85 30.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.94 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -68.94 0.26 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.861 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.593 ' O ' ' N ' ' A' ' 49' ' ' LYS . 39.8 mt-10 -48.23 -54.05 14.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.79 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.8 OUTLIER -45.9 -51.66 12.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.796 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.791 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -64.23 -23.35 67.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.172 -179.837 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.58 11.43 18.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.242 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.593 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -130.4 -8.62 4.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.743 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.665 ' HD1' ' HA ' ' A' ' 46' ' ' PHE . 84.0 m-85 -136.58 -63.5 0.62 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.85 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.558 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 1.4 m-20 157.25 117.98 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.258 -179.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.791 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 20.6 Cg_endo -60.86 167.08 9.23 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.422 2.081 . . . . 0.0 112.42 -179.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.779 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.0 OUTLIER -108.86 122.18 46.66 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.039 0.536 . . . . 0.0 110.803 0.046 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.816 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 36.5 m95 -93.48 149.92 20.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 112.034 -179.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.757 ' HD1' ' HB ' ' B' ' 66' ' ' VAL . 5.4 m-70 -127.37 103.49 7.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.418 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.871 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.6 OUTLIER -112.45 132.41 55.07 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.503 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.025 HG21 HG21 ' B' ' 57' ' ' ILE . 29.1 mm -120.24 107.17 20.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.167 178.755 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.039 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.8 p -107.5 131.21 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.966 0.412 . . . . 0.0 111.609 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.924 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.9 -142.79 3.52 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.817 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.441 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -160.21 3.58 0.08 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.743 0.272 . . . . 0.0 111.679 -179.856 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -177.4 31.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.422 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 1.071 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -92.37 -160.28 0.73 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.964 0.412 . . . . 0.0 110.983 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.736 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -152.72 78.59 0.2 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.034 -0.603 . . . . 0.0 111.941 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . 1.078 ' HB2' HD12 ' B' ' 57' ' ' ILE . 25.6 p -72.9 140.27 47.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.972 0.415 . . . . 0.0 111.142 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.818 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 61.2 t80 -152.68 84.17 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.513 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.869 HG21 ' CE1' ' A' ' 86' ' ' PHE . 3.2 m -132.21 168.08 24.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.282 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . 1.01 HG21 HG21 ' B' ' 53' ' ' THR . 1.3 t -83.78 -178.48 7.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.616 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.755 ' CD2' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -130.13 153.03 48.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.705 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.957 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 5.3 mm-40 -127.05 -124.61 0.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.272 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.545 ' OG1' ' HE2' ' A' ' 87' ' ' LYS . 11.2 p -31.11 -99.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.779 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.701 ' O ' ' HB2' ' A' ' 13' ' ' MET . 3.0 mmtp -73.18 27.61 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.093 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.772 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 21.1 m-70 62.05 -90.63 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.772 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER 161.66 158.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.503 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 1.049 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -127.77 134.7 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.023 0.44 . . . . 0.0 111.301 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.788 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 1.4 t80 -124.79 138.84 54.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.161 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.861 ' CD2' HG22 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -163.65 164.45 23.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.876 0.37 . . . . 0.0 111.032 -179.692 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.981 ' HD1' ' HB2' ' A' ' 82' ' ' ALA . 74.6 t80 -127.49 94.52 4.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.081 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.101 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.6 mm? -44.05 158.21 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.855 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.455 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.92 -28.91 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.639 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' A' ' 78' ' ' LEU . 13.5 pt20 -153.13 33.41 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.918 0.39 . . . . 0.0 110.946 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.966 HG11 HD21 ' A' ' 29' ' ' LEU . 72.6 t -156.48 170.89 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.981 ' HB2' ' HD1' ' A' ' 77' ' ' TYR . . . -136.56 119.05 15.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.858 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.823 HD11 HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -111.6 129.33 67.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.003 0.43 . . . . 0.0 111.612 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 1.012 HD22 ' HB2' ' A' ' 64' ' ' SER . 0.6 OUTLIER -116.22 92.0 3.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.279 179.647 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.871 HD12 ' HB3' ' A' ' 56' ' ' CYS . 3.1 mp -92.85 135.15 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.003 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.869 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.4 p90 -171.65 121.14 0.49 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.058 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.816 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 1.8 ptmt -104.53 143.16 33.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.785 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.957 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -105.44 16.77 25.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 110.814 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.442 -1.199 . . . . 0.0 112.31 179.845 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.884 0.374 . . . . 0.0 111.243 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.403 ' O ' ' HB3' ' B' ' 3' ' ' ASP . 62.9 m -103.29 -62.7 1.25 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.714 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.464 ' OD1' ' C ' ' B' ' 3' ' ' ASP . 28.4 p30 179.05 178.52 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.778 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.949 HH21 HD13 ' B' ' 8' ' ' ILE . 7.8 tpt180 60.89 6.71 1.26 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.004 0.431 . . . . 0.0 110.568 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.671 ' O ' HD13 ' B' ' 78' ' ' LEU . 13.3 tttt -30.62 111.62 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.935 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.98 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 160.74 -172.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.853 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.779 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 53.0 t -150.36 71.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.813 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.961 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.84 143.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.973 -179.803 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.779 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 8.8 mmpt? -112.17 -28.41 7.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.923 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.618 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 4.0 t-20 -157.5 -91.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.241 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.806 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 78.44 97.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.066 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.2 t0 -90.47 29.84 1.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.18 0.514 . . . . 0.0 109.975 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.921 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.0 OUTLIER -116.25 153.26 32.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.606 -179.66 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.755 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -37.0 154.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.693 ' HA ' HE21 ' B' ' 18' ' ' GLN . 0.0 OUTLIER -61.79 -68.22 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.794 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -48.3 -24.06 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.666 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.921 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -76.88 -42.56 39.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.851 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 1.1 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -65.32 -29.15 69.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.035 0.445 . . . . 0.0 110.252 179.525 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.505 ' NE2' ' HD3' ' B' ' 4' ' ' ARG . 4.3 mm100 -77.59 -43.26 32.23 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.28 0.562 . . . . 0.0 109.598 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.617 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.9 OUTLIER -69.78 -27.69 65.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.682 178.895 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.804 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 2.5 t -68.04 -49.56 60.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.928 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.908 HG22 ' CD2' ' B' ' 76' ' ' PHE . 76.7 t -55.77 -46.54 79.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.156 179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.53 -40.26 86.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.023 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.626 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 1.3 m -66.68 -34.28 77.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.759 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.829 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.45 -32.26 68.11 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.243 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.522 ' HA ' HD12 ' B' ' 29' ' ' LEU . 12.4 m -70.94 -41.25 71.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.142 -1.39 . . . . 0.0 109.858 178.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.797 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 33.8 mm-40 -55.83 -46.9 78.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.752 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 1.002 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -65.58 -34.39 78.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.403 179.239 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.829 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -66.21 -50.18 64.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.16 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 30' ' ' GLU . . . . . 0.683 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -66.7 -27.59 67.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.013 -179.811 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.797 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 28.0 mmtp -85.68 -26.81 25.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.89 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.573 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -157.33 151.78 25.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.729 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.679 ' C ' HD13 ' B' ' 34' ' ' ILE . 1.5 p30 -113.28 36.37 3.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.903 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.83 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.6 mm -118.98 108.72 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.932 ' HA ' HD12 ' B' ' 38' ' ' ILE . 54.7 mm-40 -29.7 -71.08 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.024 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.465 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.1 OUTLIER -46.32 -45.99 17.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.895 0.379 . . . . 0.0 110.646 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.83 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 15.0 t0 -58.92 -61.28 2.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.85 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 1.002 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 2.1 mt -43.93 -47.75 2.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.816 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 1.042 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -57.14 -59.43 5.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.529 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -45.63 -61.57 1.65 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.779 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.9 OUTLIER -41.62 -49.04 4.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.264 179.387 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.666 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 18.8 mt -61.51 -68.64 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.815 ' HE2' ' HB3' ' B' ' 47' ' ' ASP . 1.4 tptm -39.62 -27.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.689 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -75.98 -60.34 2.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.0 0.429 . . . . 0.0 110.858 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.736 ' HG2' ' O ' ' B' ' 41' ' ' HIS . 0.4 OUTLIER -60.56 -25.88 66.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.04 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.804 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -76.86 -48.04 19.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.419 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.815 ' HB3' ' HE2' ' B' ' 43' ' ' LYS . 3.2 p30 -64.21 -27.17 68.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.274 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.439 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -90.03 -41.61 11.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.029 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.68 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -79.04 -20.02 49.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.048 -179.632 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.685 ' CD1' ' HA ' ' B' ' 46' ' ' PHE . 8.9 m-85 -128.66 -70.03 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.452 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.667 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 36.5 t30 157.38 117.58 0.0 OUTLIER Pre-proline 0 CA--C 1.529 0.163 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.479 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.8 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 30.1 Cg_endo -63.01 170.1 8.03 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.369 2.046 . . . . 0.0 112.526 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 53' ' ' THR . . . . . 1.01 HG21 HG21 ' A' ' 67' ' ' THR . 0.6 OUTLIER -103.54 132.49 49.74 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 122.822 0.449 . . . . 0.0 110.544 0.041 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.774 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 46.4 m95 -101.62 104.66 15.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.574 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.849 ' HE1' HG22 ' A' ' 67' ' ' THR . 37.1 m-70 -69.42 90.71 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 23.8 p -105.06 123.73 48.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.059 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 1.078 HD12 ' HB2' ' A' ' 64' ' ' SER . 19.0 mm -118.08 108.28 24.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.088 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.042 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.4 p -111.07 120.91 62.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.868 0.366 . . . . 0.0 111.369 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.639 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.77 -136.09 3.47 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.063 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.575 ' O ' ' ND2' ' B' ' 61' ' ' ASN . 0.4 OUTLIER -162.67 5.61 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 120.873 0.368 . . . . 0.0 111.13 -179.568 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.575 ' ND2' ' O ' ' B' ' 60' ' ' ARG . 0.5 OUTLIER 171.18 31.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 1.071 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -89.29 -170.4 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.024 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.853 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -139.46 76.92 0.33 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.081 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.979 ' CB ' HD12 ' A' ' 57' ' ' ILE . 9.6 p -69.66 138.12 52.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.012 0.434 . . . . 0.0 111.191 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.763 ' H ' HD13 ' A' ' 57' ' ' ILE . 68.3 t80 -146.24 88.55 1.8 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.828 HG21 ' CE1' ' B' ' 86' ' ' PHE . 10.2 m -125.74 145.68 32.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.348 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.779 HG21 ' CG2' ' A' ' 53' ' ' THR . 0.0 OUTLIER -80.13 70.05 6.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.632 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.428 ' N ' ' CD2' ' B' ' 68' ' ' HIS . 0.3 OUTLIER -51.24 160.91 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.733 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' B' ' 71' ' ' LYS . 0.8 OUTLIER -156.84 -144.75 0.14 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.768 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.528 ' OG1' ' N ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 39.99 -90.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.729 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.5 OUTLIER 163.21 21.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 179.938 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.495 ' HB3' ' CZ3' ' B' ' 54' ' ' TRP . 39.6 m80 -115.96 52.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.765 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.867 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.9 t80 -127.34 123.92 37.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 1.1 HG13 ' HB3' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -135.42 117.36 20.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.537 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.566 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -103.35 134.74 46.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.007 178.972 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.961 ' HE1' HG23 ' B' ' 74' ' ' ILE . 0.5 OUTLIER -162.68 169.15 20.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.902 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.568 ' O ' ' N ' ' B' ' 7' ' ' VAL . 49.4 t80 -135.38 115.77 13.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.756 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 0.98 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -68.77 169.99 10.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.763 -179.769 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.427 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -35.09 -35.46 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.742 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' B' ' 78' ' ' LEU . 1.4 pt20 -154.38 33.8 0.42 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.823 0.344 . . . . 0.0 111.134 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.63 HG12 ' N ' ' B' ' 82' ' ' ALA . 55.3 t -152.83 168.22 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.613 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.918 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -131.62 152.29 50.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.819 0.343 . . . . 0.0 111.111 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.918 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -141.95 123.77 13.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.393 -179.628 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.924 HD23 HG12 ' B' ' 57' ' ' ILE . 0.4 OUTLIER -117.89 90.2 3.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.404 179.756 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.78 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -94.64 130.78 40.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.618 -179.442 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.867 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 16.8 p90 -169.01 132.53 1.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.476 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.774 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 1.2 mtpp -108.16 170.47 7.98 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.733 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.449 ' OG ' ' CB ' ' A' ' 88' ' ' SER . 0.2 OUTLIER -122.01 19.89 10.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.306 0.574 . . . . 0.0 110.998 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.426 -1.208 . . . . 0.0 112.598 -179.919 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtp . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.817 0.341 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.12 85.33 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.951 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.767 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 1.3 m-20 -117.8 -133.25 0.32 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.083 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.86 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -122.95 70.16 1.01 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.141 -179.823 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.592 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 22.3 tptm -85.17 44.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.791 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.976 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.28 173.7 9.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.406 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.742 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 38.5 t -132.7 81.32 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.674 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.873 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -50.32 150.62 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.978 0.418 . . . . 0.0 110.505 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.762 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -159.42 1.11 0.08 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.787 -179.771 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.821 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 2.4 t-20 -160.25 77.55 0.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.553 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.683 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.06 174.35 6.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.232 0.539 . . . . 0.0 111.879 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.678 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -174.03 28.51 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.398 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.86 ' H ' HE22 ' A' ' 18' ' ' GLN . 16.0 ttp -124.45 171.15 10.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.688 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.706 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.4 OUTLIER -53.57 138.24 34.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.656 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -43.95 -67.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.52 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -48.15 -34.13 9.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.94 -179.994 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.744 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 47.2 mmm -68.92 -29.83 68.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.862 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.981 ' HA ' HD12 ' A' ' 74' ' ' ILE . 1.6 mm100 -74.21 -39.09 63.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.654 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.86 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 6.9 mt-30 -74.83 -34.23 62.3 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.3 OUTLIER -73.53 -36.86 65.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.642 178.988 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.971 ' HB2' HD22 ' A' ' 85' ' ' LEU . 56.6 p -62.91 -47.38 83.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.835 178.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.972 HG23 ' O ' ' A' ' 18' ' ' GLN . 26.3 t -57.64 -49.97 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.767 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 40.9 mt-10 -55.14 -38.57 68.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.213 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.69 -37.39 84.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.187 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.717 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -70.93 -27.83 64.05 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 178.517 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 5.3 m -73.85 -39.99 63.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.355 178.472 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.59 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -56.51 -45.36 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.629 178.971 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.878 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -75.3 -23.38 57.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.752 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 1.062 HD21 HG11 ' A' ' 81' ' ' VAL . 7.0 mt -73.94 -34.02 64.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -94.17 -21.75 18.88 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.533 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.614 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 41.0 mmtm -90.1 -13.16 36.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.676 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.681 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -152.26 -142.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.61 ' HA ' HD11 ' A' ' 38' ' ' ILE . 7.9 m-20 159.88 34.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.501 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.949 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 33.2 mm -113.97 39.21 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.184 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.787 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.6 mp0 36.69 -87.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.58 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.677 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.06 -43.42 3.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.378 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.949 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.9 t70 -60.45 -57.62 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.335 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.878 HG23 ' HB3' ' A' ' 28' ' ' ALA . 3.2 mt -48.3 -55.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.856 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -53.1 -46.65 68.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.88 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.717 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -52.03 -54.56 28.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.054 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.552 ' HD1' ' HB1' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -60.82 -55.21 35.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.737 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.748 HD11 HG22 ' A' ' 38' ' ' ILE . 76.3 mt -44.31 -56.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.137 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.84 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.2 OUTLIER -53.42 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.754 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.579 ' HA ' ' OD2' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -35.61 -53.81 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.565 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.2 mm-40 -51.37 -58.94 4.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.78 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.743 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 3.0 m-85 -52.35 -48.6 65.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.786 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.801 ' HB2' ' HB3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -61.54 -19.25 61.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.653 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.34 12.3 10.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.0 OUTLIER -124.44 -16.87 6.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.096 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.701 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 27.1 m-85 -140.1 -55.36 0.54 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.801 0.334 . . . . 0.0 111.238 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.701 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 3.5 t30 160.1 119.77 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.169 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.314 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.801 ' HB3' ' HB2' ' A' ' 47' ' ' ASP . 39.4 Cg_endo -67.02 166.87 21.47 Favored 'Trans proline' 0 CA--C 1.532 0.399 0 C-N-CA 122.464 2.109 . . . . 0.0 112.344 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.811 HG22 ' CE1' ' A' ' 55' ' ' HIS . 3.7 m -106.64 128.28 54.04 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 122.817 0.447 . . . . 0.0 110.77 0.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.796 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.7 m95 -94.64 123.38 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.856 -179.523 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.892 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.0 OUTLIER -106.9 97.69 7.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.588 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.882 ' HB2' HD12 ' A' ' 85' ' ' LEU . 27.7 p -117.5 162.37 18.09 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.93 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 16.5 mm -129.47 168.48 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.01 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.9 p -165.04 110.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.899 0.38 . . . . 0.0 111.479 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.792 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -146.48 -128.14 1.9 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.205 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.564 ' HG3' ' NH1' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -167.14 -37.67 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.785 0.326 . . . . 0.0 111.121 -179.755 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -140.16 52.61 1.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.247 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 1.053 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.4 OUTLIER -110.11 168.46 9.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.374 . . . . 0.0 110.758 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.901 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -115.1 81.31 0.3 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.959 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.927 ' HA ' HG12 ' B' ' 57' ' ' ILE . 1.0 OUTLIER -76.06 137.95 40.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.968 0.414 . . . . 0.0 111.472 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.742 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 9.1 t80 -151.16 65.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.42 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.678 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 28.5 m -112.78 161.74 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.187 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.767 HG23 ' N ' ' A' ' 68' ' ' HIS . 2.8 t -81.65 -149.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.952 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.767 ' N ' HG23 ' A' ' 67' ' ' THR . 5.7 p-80 179.59 161.2 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.711 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -161.64 165.07 28.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.041 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.456 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 9.1 m 68.72 -93.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.126 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER 168.3 67.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.858 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 95.9 m-70 -154.73 16.73 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.988 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 8.8 t80 -99.4 101.0 12.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.37 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.981 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -123.56 118.87 55.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.958 0.408 . . . . 0.0 111.595 -179.898 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.821 ' HB3' ' HB3' ' A' ' 10' ' ' ASN . 75.9 t80 -112.76 135.03 53.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.111 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.873 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -150.13 176.55 10.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.877 0.37 . . . . 0.0 111.203 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.778 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 7.2 t80 -132.4 99.45 4.68 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.19 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.976 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.9 mm? -65.24 -174.83 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.329 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.46 ' O ' ' CB ' ' A' ' 80' ' ' GLN . . . -60.18 85.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.062 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.778 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 5.7 tt0 82.68 12.31 0.52 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.807 0.337 . . . . 0.0 110.739 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 1.062 HG11 HD21 ' A' ' 29' ' ' LEU . 68.5 t -136.09 173.58 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.853 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.807 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -148.99 154.67 39.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.858 0.361 . . . . 0.0 111.142 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.807 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.4 OUTLIER -139.95 116.08 8.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.037 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.93 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 12.6 tp -97.98 86.52 3.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.785 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.971 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -90.48 139.24 30.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.051 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.988 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.0 OUTLIER -172.53 121.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.355 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.857 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.8 OUTLIER -94.21 118.99 32.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.792 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.864 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -85.37 18.98 2.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.311 0.576 . . . . 0.0 110.784 -179.987 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.35 -1.25 . . . . 0.0 112.533 179.876 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.599 ' C ' ' SG ' ' B' ' 2' ' ' CYS . 13.6 mtm . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.797 0.332 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.599 ' SG ' ' C ' ' B' ' 1' ' ' MET . 0.0 OUTLIER -167.9 81.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.91 179.954 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.444 ' HB2' ' OE2' ' B' ' 23' ' ' GLU . 4.0 m-20 -145.2 -4.39 0.71 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.042 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.674 ' HD2' ' OE1' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -80.32 66.43 5.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.765 179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -89.99 36.08 0.86 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.073 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.071 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -110.52 -155.33 0.56 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.055 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.563 ' N ' ' O ' ' B' ' 77' ' ' TYR . 6.8 t -158.36 67.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.134 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.896 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.1 mp -35.66 142.84 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 110.153 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 1.008 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 5.2 mmpt? -120.86 -22.41 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.467 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 38.1 t-20 -150.21 -104.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.308 179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.755 ' CB ' ' HA ' ' B' ' 74' ' ' ILE . . . 69.25 145.34 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.176 0.512 . . . . 0.0 111.743 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.565 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -145.17 25.49 1.39 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.647 179.216 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.648 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 20.1 ttp -102.04 166.47 10.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.989 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.733 ' HB2' ' HG3' ' B' ' 17' ' ' MET . 2.2 m -47.68 143.52 3.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.814 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 3.4 pt-20 -49.84 -69.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.864 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.761 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -47.34 -21.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.763 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.733 ' HG3' ' HB2' ' B' ' 14' ' ' SER . 0.0 OUTLIER -82.39 -37.73 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.017 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 0.99 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.26 -34.72 68.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.659 179.869 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.674 ' OE1' ' HD2' ' B' ' 4' ' ' ARG . 37.7 mt-30 -77.86 -40.42 40.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.927 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.761 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -69.15 -33.44 73.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.638 179.161 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.869 ' HB2' HD22 ' B' ' 85' ' ' LEU . 0.6 OUTLIER -65.48 -49.28 69.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.154 179.286 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.984 HG22 ' CD2' ' B' ' 76' ' ' PHE . 84.1 t -59.94 -37.11 70.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.162 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 23' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 62.2 mt-10 -63.86 -35.05 79.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.344 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.502 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 3.5 t -72.82 -34.61 66.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 109.798 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.741 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -72.63 -35.04 67.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.328 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.924 ' HA ' HD12 ' B' ' 29' ' ' LEU . 51.7 m -69.83 -43.89 71.05 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.622 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.813 ' HG3' ' N ' ' B' ' 28' ' ' ALA . 0.9 OUTLIER -52.73 -46.84 67.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.526 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.813 ' N ' ' HG3' ' B' ' 27' ' ' GLN . . . -71.28 -24.14 62.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.721 178.793 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.924 HD12 ' HA ' ' B' ' 26' ' ' THR . 3.5 mt -71.34 -36.82 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.543 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -86.74 -28.83 22.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.625 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.779 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 44.7 mmtm -84.25 -27.61 27.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.766 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -148.87 164.49 34.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.662 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.49 ' C ' HD13 ' B' ' 34' ' ' ILE . 9.7 m120 -129.65 31.25 4.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 1.053 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.2 mm -113.7 107.1 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.901 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 13.9 mp0 -31.15 -67.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.545 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -48.57 -60.69 2.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.789 179.594 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 1.053 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.2 m-20 -45.29 -65.1 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.664 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.829 ' HB ' HG11 ' B' ' 58' ' ' VAL . 9.9 mt -41.91 -46.74 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.127 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 1.047 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -64.88 -42.46 94.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.984 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.742 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -57.85 -59.44 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.156 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.697 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -53.53 -55.06 28.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.661 179.985 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.81 HD11 HG22 ' B' ' 38' ' ' ILE . 37.7 mt -45.5 -69.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.698 ' HD2' ' HE2' ' A' ' 65' ' ' TYR . 4.4 tmtt? -45.21 -36.45 3.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.898 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.511 ' O ' ' HE2' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -65.94 -50.01 65.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.977 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.769 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.8 OUTLIER -64.86 -35.88 82.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.912 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.798 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -68.61 -40.52 80.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.029 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.78 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.43 -39.07 85.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.899 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -32.37 34.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.769 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.82 -13.28 39.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.776 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.722 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 98.6 m-85 -123.58 -73.23 0.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.48 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.722 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 60.3 t30 159.21 113.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.172 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.78 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 78.5 Cg_exo -42.13 151.06 0.21 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.208 1.939 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.759 HG23 ' CE1' ' B' ' 55' ' ' HIS . 2.8 t -122.41 131.84 54.08 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 122.895 0.478 . . . . 0.0 110.51 0.086 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 1.019 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 53.3 m95 -96.16 126.01 41.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.716 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.759 ' CE1' HG23 ' B' ' 53' ' ' THR . 0.0 OUTLIER -98.13 94.08 6.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.092 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 1.039 ' HB3' HD12 ' B' ' 85' ' ' LEU . 1.8 m -112.61 169.68 8.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.437 0.637 . . . . 0.0 112.015 -177.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.935 HD12 HD23 ' B' ' 84' ' ' LEU . 32.8 mt -158.34 162.19 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.346 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.047 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.2 p -159.54 114.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.003 0.43 . . . . 0.0 111.488 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.816 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -143.2 -133.92 2.82 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.942 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.404 ' H ' ' H ' ' B' ' 61' ' ' ASN . 5.3 ptm180 -172.88 10.03 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.778 0.323 . . . . 0.0 111.168 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.44 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -174.62 32.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.216 -179.908 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 1.053 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 8.8 p90 -102.81 168.34 9.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.05 0.452 . . . . 0.0 111.142 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -121.79 81.84 0.35 Allowed Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.064 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.923 ' HA ' HG23 ' A' ' 57' ' ' ILE . 8.7 p -75.88 123.27 25.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.959 0.409 . . . . 0.0 111.324 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.84 ' HE2' ' HD2' ' A' ' 43' ' ' LYS . 10.8 t80 -134.85 68.88 1.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.507 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.904 HG21 ' CE1' ' B' ' 86' ' ' PHE . 4.6 m -114.88 150.99 16.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.457 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 16.3 m -87.37 95.99 10.2 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.857 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.807 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 10.6 p-80 -61.87 159.08 14.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.573 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -152.65 -171.6 3.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.614 179.98 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.593 HG22 ' HG2' ' B' ' 71' ' ' LYS . 29.8 m 51.68 -119.54 1.47 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.413 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.593 ' HG2' HG22 ' B' ' 70' ' ' THR . 55.5 mmtt -72.95 31.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 0.0 110.202 179.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.807 ' O ' ' HB2' ' B' ' 68' ' ' HIS . 63.2 m-70 61.49 -93.67 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.496 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.793 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 159.4 -161.06 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.99 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.5 OUTLIER -165.3 111.66 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.049 179.24 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.549 ' HE1' ' HZ ' ' B' ' 62' ' ' PHE . 9.6 t80 -110.12 98.27 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.984 ' CD2' HG22 ' B' ' 22' ' ' VAL . 3.6 p90 -118.58 169.67 9.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.67 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 31.2 t80 -132.27 113.21 12.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.522 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.071 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -70.39 169.87 13.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.73 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.516 ' C ' ' HG2' ' B' ' 80' ' ' GLN . . . -24.76 -47.63 0.02 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.117 -0.564 . . . . 0.0 113.218 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.516 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -145.71 29.83 1.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.644 0.259 . . . . 0.0 111.142 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.816 HG13 ' O ' ' B' ' 59' ' ' GLY . 97.1 t -143.61 170.11 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.285 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.771 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -137.1 126.09 24.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.552 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.658 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.3 OUTLIER -114.66 124.05 70.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.134 0.493 . . . . 0.0 111.832 -179.399 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.935 HD23 HD12 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -106.85 93.96 4.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.039 179.655 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 1.039 HD12 ' HB3' ' B' ' 56' ' ' CYS . 0.5 OUTLIER -100.43 122.86 43.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.276 -179.414 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.904 ' CE1' HG21 ' B' ' 66' ' ' VAL . 18.3 p90 -163.83 115.06 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.319 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 1.019 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 5.6 ptmt -105.02 158.32 16.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.684 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.573 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.6 OUTLIER -95.52 19.45 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.229 0.538 . . . . 0.0 110.869 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 89' ' ' GLY . . . . . 0.745 ' HA2' ' CE ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.47 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.854 0.359 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.5 t 64.97 156.43 0.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.728 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -84.72 -149.91 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.78 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -98.37 -46.58 5.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.874 -179.972 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.62 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.1 OUTLIER 39.06 38.87 0.34 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.17 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.045 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -141.67 173.34 11.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.244 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.47 ' HB ' ' HB3' ' A' ' 77' ' ' TYR . 39.0 t -139.05 75.78 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.033 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.828 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -38.89 160.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.13 0.49 . . . . 0.0 110.637 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.734 ' HD3' ' O ' ' A' ' 8' ' ' ILE . 2.8 mmtp -159.44 -6.96 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.63 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.477 ' CG ' ' HZ ' ' A' ' 73' ' ' PHE . 19.7 t30 -167.51 71.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.393 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.877 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -117.5 92.36 3.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.664 -179.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.811 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 53.7 m-20 -90.53 26.41 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.154 0.502 . . . . 0.0 110.246 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.775 ' HG3' ' H ' ' A' ' 14' ' ' SER . 16.0 ttp -109.85 173.33 6.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.775 ' H ' ' HG3' ' A' ' 13' ' ' MET . 1.2 t -57.91 140.85 51.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.86 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.571 ' HA ' ' CG ' ' A' ' 18' ' ' GLN . 11.9 mt-10 -47.98 -62.91 1.23 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.967 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 1.1 mt-10 -51.68 -31.62 26.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.566 ' SD ' ' HD3' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -72.57 -45.59 58.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 1.007 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -62.4 -36.86 83.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.943 179.957 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.549 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 4.9 mt-30 -73.57 -35.17 65.43 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.483 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -74.05 -27.74 61.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.699 178.917 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.829 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.4 t -71.22 -41.03 70.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.06 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.958 HG22 ' CD2' ' A' ' 76' ' ' PHE . 94.7 t -65.58 -46.67 88.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.613 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.719 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 58.2 mt-10 -57.97 -41.7 83.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.114 179.399 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 20.3 m -64.35 -37.04 86.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.758 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.891 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -69.99 -32.56 70.82 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 22' ' ' VAL . 1.6 m -69.27 -38.82 78.56 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.47 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.775 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 57.5 mt-30 -59.22 -41.01 87.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.943 179.289 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.99 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -73.21 -31.72 64.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.132 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.891 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.3 mt -72.13 -35.68 69.18 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.327 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -93.17 -11.78 31.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.352 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.775 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 8.4 mttm -96.43 -19.82 18.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.723 0.297 . . . . 0.0 111.216 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.594 ' HE1' ' ND1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -151.46 -62.77 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.031 179.955 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.935 ' HA ' HD11 ' A' ' 38' ' ' ILE . 5.7 t-20 74.83 61.12 0.07 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.75 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.057 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 44.3 mm -141.21 57.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.011 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.617 ' O ' HG13 ' A' ' 58' ' ' VAL . 1.5 mp0 31.87 -91.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.974 0.416 . . . . 0.0 110.266 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.673 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -44.02 -54.03 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.214 179.105 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 1.057 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -52.26 -58.29 7.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.978 179.632 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.99 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 24.5 mt -48.22 -43.42 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.939 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.896 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -62.22 -49.62 75.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.765 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.815 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -53.26 -45.74 68.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.776 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.827 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -57.2 -58.44 8.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.622 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.917 HG21 HD11 ' A' ' 85' ' ' LEU . 8.0 mt -50.42 -74.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.367 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.721 ' HD3' ' CD2' ' B' ' 65' ' ' TYR . 7.6 tttt -39.11 -40.62 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.799 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.587 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.21 -62.36 1.7 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.038 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -60.48 -58.95 6.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.871 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.829 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.9 OUTLIER -42.02 -38.19 1.57 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.769 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -69.35 -43.74 73.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.837 -179.855 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.998 ' HE3' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -95.94 9.78 39.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.316 -179.844 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -129.96 -5.54 4.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.119 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.793 ' HD1' ' HA ' ' A' ' 46' ' ' PHE . 75.9 m-85 -138.39 -61.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.224 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.5 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.7 OUTLIER 158.8 109.62 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.223 -179.708 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.769 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 51.7 Cg_exo -54.23 148.81 39.26 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.39 2.06 . . . . 0.0 112.734 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.892 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.2 OUTLIER -117.42 144.12 45.31 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.882 0.473 . . . . 0.0 110.731 -0.021 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.651 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 70.7 m95 -101.19 114.88 29.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.499 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.807 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -86.3 92.31 8.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.812 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 1.055 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.4 OUTLIER -106.81 144.36 33.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.233 0.539 . . . . 0.0 112.293 -178.412 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.046 HD11 HG13 ' B' ' 66' ' ' VAL . 14.5 mm -132.81 107.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.341 179.02 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.896 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.1 p -107.47 129.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.954 0.407 . . . . 0.0 111.479 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.764 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.98 -127.07 1.06 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.057 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.508 ' O ' ' HE2' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -160.56 -54.48 0.05 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 120.746 0.307 . . . . 0.0 111.23 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.814 ' HB3' ' CZ ' ' B' ' 60' ' ' ARG . 1.6 m-20 -130.94 67.54 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.084 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.814 ' HE2' ' HB3' ' A' ' 64' ' ' SER . 1.4 p90 -122.57 -166.02 1.37 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.872 0.368 . . . . 0.0 110.861 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.601 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -138.07 75.51 0.38 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.029 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.814 ' HA ' HG23 ' B' ' 57' ' ' ILE . 73.8 p -67.86 133.71 49.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.828 0.347 . . . . 0.0 111.177 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.877 ' HD2' ' HG2' ' B' ' 43' ' ' LYS . 16.1 t80 -151.42 79.54 1.29 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.897 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.955 HG21 ' CD1' ' A' ' 86' ' ' PHE . 21.2 m -110.09 176.67 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.039 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.786 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 55.1 m -107.01 108.97 20.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.83 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.625 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -57.89 157.39 7.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 179.938 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.725 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 9.9 mm-40 -136.96 -125.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.923 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.482 ' O ' ' O ' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -30.18 -97.61 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.225 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.566 ' HD3' ' SD ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -78.94 46.55 0.7 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.521 -179.972 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.811 ' ND1' ' HB3' ' A' ' 12' ' ' ASP . 18.8 m170 47.48 -90.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.623 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.749 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 4.7 p90 163.13 -160.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.594 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 1.007 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -168.08 129.8 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.581 179.743 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 15.4 t80 -123.19 136.14 54.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.612 178.718 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.958 ' CD2' HG22 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -154.57 168.87 25.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.996 0.427 . . . . 0.0 111.193 -179.314 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.704 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 11.7 t80 -127.1 99.09 5.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.187 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.045 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -65.91 -175.06 0.27 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 179.76 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.451 ' O ' ' HB3' ' A' ' 80' ' ' GLN . . . -58.11 86.78 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.978 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.451 ' HB3' ' O ' ' A' ' 79' ' ' GLY . 48.0 tt0 78.01 23.25 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 0.0 110.195 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.764 HG13 ' O ' ' A' ' 59' ' ' GLY . 45.5 t -141.97 167.13 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.782 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.806 ' HB3' ' HE1' ' A' ' 62' ' ' PHE . . . -146.43 118.58 8.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.795 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -105.11 139.99 24.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.973 0.416 . . . . 0.0 111.609 -179.53 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.974 HD23 HG12 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -124.7 94.53 4.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.378 179.644 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 1.055 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -99.6 129.14 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.556 -179.318 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.955 ' CD1' HG21 ' A' ' 66' ' ' VAL . 1.4 p90 -166.32 119.37 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.909 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.651 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -105.82 151.79 24.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.067 -179.949 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.725 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.1 OUTLIER -98.4 18.33 16.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.175 0.512 . . . . 0.0 110.809 179.925 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.454 -1.192 . . . . 0.0 112.474 -179.976 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.872 ' HG2' ' H ' ' B' ' 2' ' ' CYS . 28.6 ttm . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.873 0.368 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.872 ' H ' ' HG2' ' B' ' 1' ' ' MET . 5.1 m -91.17 179.15 5.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.894 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 3' ' ' ASP . . . . . 0.623 ' HB2' ' O ' ' B' ' 2' ' ' CYS . 1.2 m-20 75.32 176.5 0.22 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.73 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.578 ' NH1' ' HG3' ' B' ' 4' ' ' ARG . 3.2 mmm-85 -37.78 -96.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.937 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.662 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.0 OUTLIER 77.62 98.27 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.689 -179.869 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 1.051 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.03 -168.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.767 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.691 ' CG1' ' HE2' ' B' ' 9' ' ' LYS . 99.5 t -152.78 75.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.252 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.98 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -51.01 145.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.114 0.483 . . . . 0.0 110.419 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.691 ' HE2' ' CG1' ' B' ' 7' ' ' VAL . 0.5 OUTLIER -142.16 -10.3 0.87 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.156 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.609 ' ND2' ' HZ ' ' B' ' 73' ' ' PHE . 7.1 t-20 -162.54 72.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.564 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.788 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -113.05 90.53 3.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.543 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.685 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 21.5 m-20 -90.92 26.96 1.94 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.1 0.476 . . . . 0.0 110.334 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.741 ' HG3' ' H ' ' B' ' 14' ' ' SER . 13.7 ttp -111.2 170.63 7.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.89 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.851 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 40.8 t -53.84 128.57 30.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.664 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.716 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 20.1 mt-10 -37.63 -68.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.896 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -46.51 -27.7 1.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.827 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.851 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -73.88 -45.77 48.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.976 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 1.024 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -62.18 -30.03 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.551 ' HG2' ' HD3' ' B' ' 4' ' ' ARG . 74.5 mt-30 -77.84 -41.59 36.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.052 0.453 . . . . 0.0 109.908 179.504 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.469 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -69.24 -29.26 67.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.712 179.177 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.845 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 13.9 t -68.72 -48.7 63.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.184 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.888 HG22 ' CD2' ' B' ' 76' ' ' PHE . 74.2 t -57.58 -43.8 83.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.404 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.5 -35.35 77.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.806 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 90.9 m -71.35 -35.22 71.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.738 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.765 ' HA ' HG12 ' B' ' 42' ' ' ILE . . . -71.61 -32.25 67.8 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.519 ' HA ' HD12 ' B' ' 29' ' ' LEU . 90.9 m -72.1 -42.23 66.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.372 -1.286 . . . . 0.0 109.663 178.603 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.584 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 2.0 mm-40 -52.72 -46.42 67.38 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.241 178.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.908 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -64.76 -38.18 90.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.887 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.714 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -64.07 -33.23 75.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.617 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -78.71 -32.09 46.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.764 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 5.8 mmtt -85.54 -19.91 30.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.654 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.537 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -165.98 164.37 18.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.776 179.677 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -124.55 27.99 6.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.756 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.848 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.7 mm -104.5 107.86 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.938 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.781 ' HA ' HD12 ' B' ' 38' ' ' ILE . 0.9 OUTLIER -30.31 -70.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.501 ' H ' ' HG2' ' B' ' 36' ' ' LYS . 1.8 mmmt -44.71 -49.26 10.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.848 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.4 OUTLIER -55.89 -61.02 2.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 179.754 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 1.059 ' HB ' HG11 ' B' ' 58' ' ' VAL . 2.5 mt -46.22 -56.86 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.931 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 0.88 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -44.83 -46.69 10.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.606 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.871 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -65.24 -65.49 0.67 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.436 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.624 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.8 t60 -37.09 -34.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.76 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 1.019 HG21 HD11 ' B' ' 85' ' ' LEU . 39.5 mt -73.46 -66.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.938 179.758 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.877 ' HG2' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -48.5 -24.02 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.503 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.519 ' N ' ' HD3' ' B' ' 43' ' ' LYS . 2.7 tttm -74.89 -58.38 3.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.793 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.785 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 4.1 mt-10 -62.84 -30.67 71.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.68 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.845 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -69.88 -43.29 72.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.836 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.806 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -63.22 -36.99 85.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.129 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -89.94 -24.07 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.714 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.785 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.46 -13.19 35.32 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.402 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.608 ' CE2' ' HE1' ' B' ' 17' ' ' MET . 2.6 m-85 -126.75 -71.59 0.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.461 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 3.7 m-20 162.02 113.8 0.01 OUTLIER Pre-proline 0 N--CA 1.453 -0.309 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.806 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 44.7 Cg_exo -35.63 148.25 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.523 2.149 . . . . 0.0 112.7 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.694 ' O ' ' HB3' ' B' ' 87' ' ' LYS . 2.1 m -123.98 136.73 54.49 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.102 0.561 . . . . 0.0 110.258 -0.145 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.776 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 62.5 m95 -103.03 129.0 49.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.211 0.529 . . . . 0.0 112.254 -178.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.822 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 7.8 m-70 -112.33 115.88 29.46 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.944 ' HB3' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -134.32 170.32 15.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.693 0.758 . . . . 0.0 112.687 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 0.854 HG12 ' H ' ' A' ' 65' ' ' TYR . 43.8 mt -149.54 165.94 3.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.341 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.059 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.4 p -161.06 116.02 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 0.0 111.13 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.725 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.38 -113.04 1.22 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.234 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.814 ' CZ ' ' HB3' ' A' ' 61' ' ' ASN . 0.0 OUTLIER 174.59 -4.6 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 120.579 0.228 . . . . 0.0 111.59 -179.594 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.583 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -170.86 34.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.434 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' B' ' 63' ' ' GLY . 9.5 p90 -99.84 -169.61 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.092 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.673 ' HA3' ' N ' ' A' ' 36' ' ' LYS . . . -147.5 96.69 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.742 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.995 ' CB ' HD12 ' A' ' 57' ' ' ILE . 8.8 p -81.46 149.15 28.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.141 0.496 . . . . 0.0 111.78 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.815 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 15.9 t80 -152.2 69.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.147 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 1.046 HG13 HD11 ' A' ' 57' ' ' ILE . 10.2 m -114.68 150.25 16.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.322 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.892 HG21 ' CG2' ' A' ' 53' ' ' THR . 5.2 t -77.26 119.49 20.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.082 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.557 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -83.72 148.05 27.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.71 179.807 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.755 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.88 -105.44 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.163 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.613 ' CG2' ' HB2' ' B' ' 87' ' ' LYS . 0.2 OUTLIER -37.54 -101.58 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.479 -179.728 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.62 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 2.9 mmtp -80.81 55.91 2.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.789 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.737 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 9.5 m80 30.99 -89.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.894 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.777 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 0.2 OUTLIER 165.18 -179.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.519 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 1.024 HD12 ' HA ' ' B' ' 18' ' ' GLN . 1.1 tt -151.83 115.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.639 ' HE2' ' HG ' ' B' ' 64' ' ' SER . 0.9 OUTLIER -111.39 92.76 4.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.812 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.98 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.2 p90 -111.04 168.85 9.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.647 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 49.1 t80 -130.64 112.98 13.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.618 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 1.051 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -69.16 170.36 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.75 -48.74 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.781 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.514 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 4.2 pt20 -145.95 37.57 1.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.862 0.363 . . . . 0.0 110.987 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.679 HG12 ' N ' ' B' ' 82' ' ' ALA . 69.5 t -154.68 169.08 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.01 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.969 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.6 157.74 40.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.664 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.969 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -145.07 117.12 2.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.979 0.419 . . . . 0.0 111.548 -179.702 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 0.9 HD22 ' HB3' ' B' ' 64' ' ' SER . 0.1 OUTLIER -106.74 92.29 4.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.177 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 1.019 HD11 HG21 ' B' ' 42' ' ' ILE . 0.2 OUTLIER -96.3 143.74 27.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.529 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.763 ' CE1' HG21 ' B' ' 66' ' ' VAL . 2.4 p90 179.17 136.97 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.729 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.776 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -103.74 162.88 12.72 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.647 179.506 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.822 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.4 OUTLIER -119.52 21.02 12.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.797 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.495 -179.954 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.578 ' O ' ' HB2' ' A' ' 2' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.847 0.356 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 1' ' ' MET . 42.3 t 170.24 -12.6 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.783 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.742 ' OD1' HG21 ' A' ' 26' ' ' THR . 9.4 t70 -131.82 -81.57 0.51 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.891 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.516 ' HB2' ' H ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER 70.68 -101.11 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.054 179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.516 ' H ' ' HB2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER 61.31 30.03 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.645 -179.865 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 1.089 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.11 -165.48 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.398 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.574 ' N ' ' O ' ' A' ' 77' ' ' TYR . 79.4 t -155.21 73.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ILE . . . . . 0.947 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.52 158.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.191 0.52 . . . . 0.0 110.77 -179.515 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.761 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 6.9 mmtt -156.87 -11.91 0.09 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.1 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASN . . . . . 0.501 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.1 OUTLIER -169.39 87.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.502 -179.817 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.797 ' HB1' ' OE1' ' A' ' 18' ' ' GLN . . . -123.61 95.77 4.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.836 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.781 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 8.4 m-20 -84.78 36.49 0.61 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.275 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.859 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 14.2 ttp -125.19 164.41 20.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.051 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.613 ' H ' ' HG3' ' A' ' 13' ' ' MET . 52.8 p -55.81 123.89 15.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.859 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 8.8 mt-10 -29.35 -68.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.351 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -44.38 -41.83 6.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' MET . . . . . 0.802 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -65.69 -31.02 71.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.143 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.859 ' HG3' ' HA ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -71.74 -34.54 69.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.023 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.553 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 0.9 OUTLIER -75.27 -40.45 58.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.198 0.523 . . . . 0.0 110.043 179.603 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.37 -26.27 62.72 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.825 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.843 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 35.1 t -71.34 -43.74 66.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.197 179.302 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 18' ' ' GLN . 40.5 t -61.01 -46.2 97.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.354 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.643 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 64.9 mt-10 -57.68 -43.11 84.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.312 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.564 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 3.3 m -64.21 -36.62 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.199 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.99 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -69.83 -33.47 72.34 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.742 HG21 ' OD1' ' A' ' 3' ' ' ASP . 24.0 m -68.86 -38.09 79.5 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.154 -1.384 . . . . 0.0 109.675 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.777 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 21.7 mm100 -60.34 -40.67 91.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.98 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.936 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -69.28 -33.58 73.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.743 179.047 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.862 HD21 HG11 ' A' ' 81' ' ' VAL . 1.2 mt -67.94 -45.93 72.9 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -26.5 65.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.714 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.777 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 5.9 mttp -88.75 -25.72 22.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.844 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.522 ' HE1' ' CB ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -160.07 140.66 11.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.584 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.523 ' C ' HD13 ' A' ' 34' ' ' ILE . 1.4 t-20 -103.57 30.15 5.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 0.0 110.946 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 1.009 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.9 mm -112.5 104.81 17.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.112 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 1.023 ' HA ' HD12 ' A' ' 38' ' ' ILE . 13.2 mp0 -24.34 -79.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.2 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.657 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.2 OUTLIER -40.19 -48.07 2.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.766 179.737 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 1.009 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -56.8 -54.66 43.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.793 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 1.023 HD12 ' HA ' ' A' ' 35' ' ' GLU . 2.8 mt -50.46 -48.82 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.989 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -55.46 -61.98 1.98 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.846 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.822 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -39.81 -59.67 1.13 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.936 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -49.45 -51.54 34.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.206 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.99 HG12 ' HA ' ' A' ' 25' ' ' ALA . 8.2 mt -54.04 -65.31 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.225 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.74 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 22.6 tttm -46.86 -69.47 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.066 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 44' ' ' LYS . 15.3 mmtt -33.18 -59.0 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.969 -179.774 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.747 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 3.8 tp10 -65.08 -30.67 71.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.706 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' PHE . . . . . 0.843 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -79.1 -7.48 58.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.244 -179.88 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.808 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 7.0 m-20 -101.45 -29.07 12.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.158 0.504 . . . . 0.0 110.04 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.577 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -93.76 -23.38 18.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.867 179.805 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.747 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -89.48 -17.27 28.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.217 -179.676 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.745 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 4.2 m-85 -137.91 -64.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.338 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.745 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 17.2 p-10 157.24 119.05 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.113 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.754 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.808 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 39.5 Cg_endo -66.07 170.47 11.71 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 122.56 2.174 . . . . 0.0 112.465 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.752 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 0.3 OUTLIER -104.4 132.39 50.7 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.834 0.453 . . . . 0.0 110.634 -0.147 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TRP . . . . . 0.773 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 42.7 m95 -99.78 92.46 5.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.298 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.78 ' C ' HG12 ' B' ' 66' ' ' VAL . 2.4 m170 -62.12 88.85 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 1.082 ' HB2' HD12 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -103.66 131.08 51.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.306 -178.232 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.977 ' CG1' HD23 ' A' ' 84' ' ' LEU . 19.3 mm -123.7 100.31 7.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.566 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.989 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.0 p -98.71 118.43 45.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.883 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -138.72 -128.66 2.6 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.847 -0.692 . . . . 0.0 111.902 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.575 ' HE ' ' HB3' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -165.75 -1.59 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.762 0.315 . . . . 0.0 111.051 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 4.1 t-20 174.72 35.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.924 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.816 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 6.7 p90 -87.08 166.56 14.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.051 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.877 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -116.35 84.32 0.36 Allowed Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.821 ' CB ' HD22 ' A' ' 84' ' ' LEU . 90.0 p -80.84 125.19 29.78 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.105 0.479 . . . . 0.0 111.947 -178.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.81 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 36.5 t80 -131.42 66.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.708 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.851 HG12 ' HB3' ' B' ' 55' ' ' HIS . 3.0 m -99.8 172.67 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.266 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.808 HG21 HG21 ' B' ' 53' ' ' THR . 15.5 m -111.02 72.98 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.703 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' HIS . . . . . 0.509 ' NE2' ' OD2' ' A' ' 12' ' ' ASP . 24.1 p-80 -56.44 -164.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.205 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.462 ' N ' ' CD2' ' A' ' 68' ' ' HIS . 11.4 pt-20 168.37 -153.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.667 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.487 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER 51.88 -99.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.776 ' O ' ' HA ' ' A' ' 13' ' ' MET . 3.0 pttt 173.67 20.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.79 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.859 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 62.7 m-70 -121.78 43.72 2.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.757 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PHE . . . . . 0.781 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 3.7 t80 -116.06 110.7 19.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.499 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.833 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.3 tt -123.65 127.12 73.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.317 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ASN . 58.6 t80 -120.96 110.12 15.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.451 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.947 ' HB3' HG13 ' A' ' 8' ' ' ILE . 2.2 p90 -135.68 173.89 11.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.24 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.716 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 28.4 t80 -127.23 113.95 17.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.052 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.089 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -78.4 -178.3 5.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.684 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLY . . . . . 0.623 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -60.42 90.82 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.074 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLN . . . . . 0.716 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 31.6 mt-30 78.19 21.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.865 0.364 . . . . 0.0 110.622 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.862 HG11 HD21 ' A' ' 29' ' ' LEU . 90.0 t -151.2 171.54 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.881 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.782 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -147.95 153.61 39.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.013 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.782 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.3 OUTLIER -136.29 127.29 42.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.134 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.977 HD23 ' CG1' ' A' ' 57' ' ' ILE . 4.1 tp -111.69 86.6 2.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.651 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 1.082 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -93.34 125.99 38.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 -179.67 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.787 ' CE1' HG21 ' A' ' 66' ' ' VAL . 7.5 p90 -166.72 134.74 2.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . 0.752 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.99 -162.16 0.88 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.648 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 88' ' ' SER . . . . . 0.459 ' HA ' ' OE2' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -146.6 18.84 1.32 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.176 0.512 . . . . 0.0 110.981 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.028 0 CA-C-O 118.436 -1.202 . . . . 0.0 112.599 179.989 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.444 ' HB3' ' H ' ' B' ' 2' ' ' CYS . 22.7 mmt . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.756 0.313 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 2' ' ' CYS . . . . . 0.444 ' H ' ' HB3' ' B' ' 1' ' ' MET . 69.6 m 39.98 90.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.803 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -50.63 -16.43 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.85 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' ARG . . . . . 0.443 ' HA ' ' HD3' ' B' ' 4' ' ' ARG . 6.6 mmt85 -55.69 -56.14 23.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.717 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 5' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' B' ' 6' ' ' ALA . 0.0 OUTLIER 62.07 -174.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.894 179.798 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 6' ' ' ALA . . . . . 0.997 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 71.77 170.11 0.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.447 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 7' ' ' VAL . . . . . 0.661 HG12 ' HE2' ' B' ' 9' ' ' LYS . 89.6 t -134.65 66.96 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.369 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ILE . . . . . 0.767 ' HA ' ' O ' ' B' ' 75' ' ' TYR . 0.8 OUTLIER -28.95 140.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.917 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 9' ' ' LYS . . . . . 0.661 ' HE2' HG12 ' B' ' 7' ' ' VAL . 5.7 mmtt -132.13 -0.36 3.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.628 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 10' ' ' ASN . . . . . 0.499 ' HB2' ' O ' ' B' ' 9' ' ' LYS . 2.0 t-20 171.56 87.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.733 -179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.936 ' HB1' HE21 ' B' ' 18' ' ' GLN . . . -119.4 89.86 3.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.57 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 12' ' ' ASP . . . . . 0.635 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -91.02 30.05 1.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.459 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.672 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -117.7 168.42 10.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.761 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 14' ' ' SER . . . . . 0.831 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 0.4 OUTLIER -43.02 141.63 1.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.977 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 15' ' ' GLU . . . . . 0.75 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -52.49 -58.28 7.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.674 179.718 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 16' ' ' GLU . . . . . 0.753 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -57.79 -26.3 61.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.51 179.624 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 17' ' ' MET . . . . . 0.831 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -74.27 -44.3 53.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 18' ' ' GLN . . . . . 1.034 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -65.46 -37.29 86.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.603 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -75.32 -41.06 57.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.635 179.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 20' ' ' ASP . . . . . 0.753 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.4 OUTLIER -69.81 -27.96 65.32 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.482 178.839 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 21' ' ' SER . . . . . 0.786 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -67.37 -47.35 70.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.091 179.173 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.904 HG22 ' CD2' ' B' ' 76' ' ' PHE . 73.9 t -58.22 -48.65 84.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.438 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -56.1 -39.32 71.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.404 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' CYS . . . . . 0.548 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -65.61 -36.02 82.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.985 0.421 . . . . 0.0 110.045 179.319 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.778 ' C ' HD12 ' B' ' 29' ' ' LEU . . . -68.81 -35.68 77.3 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.585 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 4.1 m -65.45 -44.25 87.81 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.744 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 27' ' ' GLN . . . . . 0.759 ' O ' ' HD2' ' B' ' 31' ' ' LYS . 10.6 mm100 -51.99 -49.32 63.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.686 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 28' ' ' ALA . . . . . 0.827 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -75.42 -16.13 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.605 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.778 HD12 ' C ' ' B' ' 25' ' ' ALA . 5.2 mt -82.12 -33.8 29.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.246 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -85.11 -33.66 22.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.386 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 31' ' ' LYS . . . . . 0.759 ' HD2' ' O ' ' B' ' 27' ' ' GLN . 0.1 OUTLIER -78.68 -29.25 45.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.952 0.406 . . . . 0.0 110.548 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 32' ' ' TYR . . . . . 0.63 ' CD1' ' N ' ' B' ' 32' ' ' TYR . 0.0 OUTLIER -149.39 151.65 34.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.64 179.789 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 33' ' ' ASN . . . . . 0.612 ' C ' HD13 ' B' ' 34' ' ' ILE . 12.2 m-80 -115.29 30.54 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.957 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 34' ' ' ILE . . . . . 0.953 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.1 mm -109.29 106.83 21.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 35' ' ' GLU . . . . . 0.877 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.0 mm-40 -31.6 -70.21 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.9 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 36' ' ' LYS . . . . . 0.509 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 5.2 mtmm -45.91 -61.05 1.9 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.873 0.368 . . . . 0.0 110.594 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 37' ' ' ASP . . . . . 0.953 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.1 m-20 -44.68 -63.6 0.87 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.765 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 38' ' ' ILE . . . . . 0.827 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 4.4 mt -43.63 -57.28 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.141 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 39' ' ' ALA . . . . . 1.05 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.14 -41.55 36.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -59.96 -64.49 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.059 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 41' ' ' HIS . . . . . 0.577 ' CD2' ' H ' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -47.34 -39.37 14.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.99 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 42' ' ' ILE . . . . . 0.716 HG21 HD11 ' B' ' 85' ' ' LEU . 81.9 mt -59.1 -60.98 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.973 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.822 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.1 OUTLIER -46.34 -55.58 7.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.893 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.595 ' O ' ' HB3' ' B' ' 48' ' ' LYS . 0.1 OUTLIER -53.85 -35.79 61.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 -179.893 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 45' ' ' GLU . . . . . 0.739 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 5.2 mm-40 -74.43 -40.32 62.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.368 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 46' ' ' PHE . . . . . 0.786 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.77 -35.03 72.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 110.715 179.99 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 47' ' ' ASP . . . . . 0.807 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.9 m-20 -74.18 -31.47 62.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.0 109.91 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 48' ' ' LYS . . . . . 0.595 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -90.0 -24.17 21.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.663 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 49' ' ' LYS . . . . . 0.739 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.24 -30.41 17.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.668 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 28.4 m-85 -123.85 -59.55 1.51 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.599 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 51' ' ' ASN . . . . . 0.503 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER 155.32 118.92 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.097 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.093 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 52' ' ' PRO . . . . . 0.807 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 18.1 Cg_endo -58.15 167.97 4.07 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.44 2.094 . . . . 0.0 112.502 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 53' ' ' THR . . . . . 0.808 HG21 HG21 ' A' ' 67' ' ' THR . 11.3 t -110.71 120.03 41.06 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.749 0.42 . . . . 0.0 110.653 0.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 54' ' ' TRP . . . . . 0.83 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 27.6 m95 -92.7 117.01 29.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.918 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 55' ' ' HIS . . . . . 0.851 ' HB3' HG12 ' A' ' 66' ' ' VAL . 0.3 OUTLIER -85.15 91.33 8.1 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.928 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 56' ' ' CYS . . . . . 0.822 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 5.7 p -101.8 150.5 23.09 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -177.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 57' ' ' ILE . . . . . 1.017 HG13 HD23 ' B' ' 84' ' ' LEU . 13.3 mm -130.56 159.34 42.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.883 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 58' ' ' VAL . . . . . 1.05 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.3 p -162.03 108.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.89 0.376 . . . . 0.0 111.046 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 59' ' ' GLY . . . . . 0.818 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -129.21 -133.93 3.7 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.953 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 60' ' ' ARG . . . . . 0.422 ' H ' ' H ' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -165.83 -9.17 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.707 0.289 . . . . 0.0 111.36 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 61' ' ' ASN . . . . . 0.575 ' HB3' ' HE ' ' A' ' 60' ' ' ARG . 0.6 OUTLIER -170.54 34.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.367 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.883 ' HB2' ' HA3' ' A' ' 59' ' ' GLY . 17.5 p90 -103.05 -168.61 1.54 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 0.0 110.682 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 63' ' ' GLY . . . . . 0.853 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -143.33 106.12 0.41 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.041 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.951 ' HB2' HD22 ' B' ' 84' ' ' LEU . 63.1 p -89.81 134.93 33.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.082 0.467 . . . . 0.0 111.47 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 65' ' ' TYR . . . . . 0.822 ' CE2' ' HA ' ' A' ' 40' ' ' ALA . 56.3 t80 -144.96 79.34 1.59 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.997 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.842 HG13 HD11 ' A' ' 57' ' ' ILE . 4.9 m -131.51 166.75 27.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.565 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 67' ' ' THR . . . . . 0.614 HG22 ' NE2' ' A' ' 55' ' ' HIS . 1.6 t -79.32 170.11 17.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.584 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 68' ' ' HIS . . . . . 0.818 ' HB3' ' CD2' ' B' ' 73' ' ' PHE . 2.4 p-80 -129.85 154.9 46.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 69' ' ' GLU . . . . . 0.711 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.0 OUTLIER -143.32 170.41 15.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.815 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 70' ' ' THR . . . . . 0.434 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 44.49 -95.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.122 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 71' ' ' LYS . . . . . 0.623 ' O ' ' HB2' ' B' ' 13' ' ' MET . 7.1 mmtt -92.17 35.05 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.098 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 72' ' ' HIS . . . . . 0.751 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 13.5 m-70 51.08 -85.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.084 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' ' HB3' ' B' ' 68' ' ' HIS . 0.3 OUTLIER 165.52 -166.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.706 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 1.034 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -162.22 124.38 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.99 0.424 . . . . 0.0 111.666 179.529 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 75' ' ' TYR . . . . . 0.97 ' CZ ' HD13 ' B' ' 84' ' ' LEU . 0.5 OUTLIER -113.82 146.38 40.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.92 178.87 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 76' ' ' PHE . . . . . 0.909 ' HE1' HG23 ' B' ' 74' ' ' ILE . 1.4 p90 -170.33 149.15 3.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.849 0.357 . . . . 0.0 111.184 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 77' ' ' TYR . . . . . 0.603 ' O ' ' N ' ' B' ' 7' ' ' VAL . 1.3 t80 -113.99 112.03 22.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.83 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 78' ' ' LEU . . . . . 0.997 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -69.18 169.67 11.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.555 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 79' ' ' GLY . . . . . 0.49 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.53 -42.64 0.02 OUTLIER Glycine 0 CA--C 1.518 0.232 0 C-N-CA 121.088 -0.577 . . . . 0.0 112.89 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 80' ' ' GLN . . . . . 0.49 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.3 OUTLIER -153.55 40.1 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.971 0.415 . . . . 0.0 110.618 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 81' ' ' VAL . . . . . 0.818 HG13 ' O ' ' B' ' 59' ' ' GLY . 77.9 t -156.4 168.46 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.055 -179.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 82' ' ' ALA . . . . . 0.999 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.58 157.48 41.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.578 179.766 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 83' ' ' ILE . . . . . 0.999 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -148.57 132.02 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 0.0 111.831 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 84' ' ' LEU . . . . . 1.017 HD23 HG13 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -125.19 101.32 6.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.257 179.332 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 85' ' ' LEU . . . . . 0.796 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 3.6 mp -101.1 133.73 45.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.12 -179.612 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 86' ' ' PHE . . . . . 0.704 ' CE1' ' HB2' ' B' ' 55' ' ' HIS . 3.2 p90 -172.68 122.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.421 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 87' ' ' LYS . . . . . 0.83 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -104.75 168.34 9.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.658 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 88' ' ' SER . . . . . 0.711 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 4.3 m -122.15 19.45 10.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.319 0.58 . . . . 0.0 110.815 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.437 -1.202 . . . . 0.0 112.546 -179.968 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.755 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 17.6 tptp . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.942 0.401 . . . . 0.0 111.051 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.05 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -110.23 -172.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.954 0.407 . . . . 0.0 111.263 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.502 ' N ' ' O ' ' A' ' 77' ' ' TYR . 95.6 t -140.04 77.35 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.747 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.804 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -42.85 149.86 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.064 0.459 . . . . 0.0 110.839 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.505 ' HE3' ' HB2' ' A' ' 77' ' ' TYR . 2.4 mmtt -137.71 -13.85 1.46 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.329 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -176.32 112.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.45 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.766 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -131.71 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 0.0 111.682 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.71 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -137.87 25.86 2.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.694 179.326 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.811 ' SD ' ' HE2' ' A' ' 17' ' ' MET . 25.7 ttp -117.08 166.44 12.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.723 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.988 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 74.4 m -51.92 135.93 29.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.715 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.723 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -41.81 -77.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.742 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.635 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.7 OUTLIER -45.95 -19.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.474 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.988 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.16 -42.22 26.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.45 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.861 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -69.27 -28.37 66.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.492 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.692 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 2.2 pt20 -75.78 -45.79 34.26 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.692 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 2.1 m-20 -67.11 -30.82 70.95 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.76 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.852 ' OG ' HD22 ' A' ' 85' ' ' LEU . 29.0 t -65.08 -47.61 76.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.922 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.811 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 56.4 t -57.85 -48.09 84.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.799 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.619 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 52.3 mt-10 -60.74 -38.3 84.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.353 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.625 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 57.1 m -66.41 -34.08 77.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.193 0.521 . . . . 0.0 109.668 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.898 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -70.21 -39.9 74.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.589 ' HA ' HD12 ' A' ' 29' ' ' LEU . 55.2 m -66.09 -38.88 89.35 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.958 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.594 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 7.6 mm-40 -58.19 -41.59 84.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.806 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.882 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -70.97 -29.14 65.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.794 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.898 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.0 OUTLIER -72.05 -41.92 66.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.026 179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.21 -36.55 77.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.184 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.523 ' HD3' ' CE1' ' A' ' 41' ' ' HIS . 2.1 mttp -79.73 -25.72 41.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.738 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.581 ' CE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.43 143.34 18.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -108.61 30.3 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.901 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.929 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 8.0 mm -110.53 111.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.849 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.741 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 8.5 mp0 -28.47 -82.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.823 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.547 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -37.19 -48.62 0.86 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.551 179.519 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.929 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.6 t70 -53.09 -63.53 1.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.804 ' HB ' HG11 ' A' ' 58' ' ' VAL . 5.3 mt -46.32 -47.06 6.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.805 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 1.026 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -56.53 -50.71 71.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.001 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.811 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -57.59 -55.46 34.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.775 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.882 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 1.2 t60 -47.1 -46.92 23.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.564 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.805 HG21 HD11 ' A' ' 85' ' ' LEU . 49.6 mt -61.1 -71.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.793 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 1.1 tmtt? -42.64 -40.56 2.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.151 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.467 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 24.3 tptt -55.57 -62.28 1.79 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.171 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.65 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp0 -62.76 -49.83 73.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.794 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -55.18 -35.67 65.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.26 -179.687 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.793 ' HB2' ' HE2' ' A' ' 43' ' ' LYS . 0.8 OUTLIER -72.02 -38.06 69.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.108 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.08 9.23 43.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.106 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.65 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -128.92 5.17 5.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.164 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.779 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 63.9 m-85 -144.61 -66.75 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.035 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.779 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 5.6 p30 162.57 109.18 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.187 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.7 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 77.0 Cg_exo -47.77 149.44 5.18 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 122.432 2.088 . . . . 0.0 112.477 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.799 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 11.0 t -119.51 135.82 54.61 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.056 0.542 . . . . 0.0 110.657 -0.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.716 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 47.4 m95 -96.67 124.61 40.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 111.741 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.736 ' HB3' ' CB ' ' B' ' 66' ' ' VAL . 0.0 OUTLIER -107.94 101.98 11.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.726 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.999 ' HB2' HD12 ' A' ' 85' ' ' LEU . 1.9 p -116.86 152.17 35.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.265 0.555 . . . . 0.0 112.425 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.055 HG21 HG21 ' B' ' 57' ' ' ILE . 20.8 mm -130.36 110.96 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.379 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.026 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.4 p -105.18 121.23 56.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.38 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.696 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -162.42 176.35 38.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.144 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.694 ' HB3' ' HA ' ' A' ' 81' ' ' VAL . 0.1 OUTLIER -138.07 40.97 2.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.651 0.262 . . . . 0.0 111.297 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.712 ' O ' ' HG2' ' B' ' 60' ' ' ARG . 2.5 t-20 168.61 25.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.885 0.374 . . . . 0.0 111.208 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.932 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 15.1 p90 -109.34 -166.95 1.15 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.609 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.851 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -150.71 102.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.047 -0.597 . . . . 0.0 111.97 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.956 ' CB ' HD12 ' B' ' 57' ' ' ILE . 88.4 p -86.11 134.57 33.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.096 0.474 . . . . 0.0 111.584 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.829 ' HB3' ' HB1' ' B' ' 39' ' ' ALA . 60.1 t80 -149.83 87.49 1.49 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.057 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.871 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 11.5 m -132.66 168.1 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.216 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.928 HG21 ' CG2' ' B' ' 53' ' ' THR . 13.2 t -92.14 83.23 5.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.571 ' C ' ' HG2' ' A' ' 69' ' ' GLU . 32.2 p-80 -55.68 -179.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.49 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HG2' ' C ' ' A' ' 68' ' ' HIS . 0.7 OUTLIER 176.38 -166.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.918 0.39 . . . . 0.0 111.228 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.49 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 58.86 -100.23 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.836 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.49 ' H ' ' HB ' ' A' ' 70' ' ' THR . 1.3 mtmp? 179.15 28.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.991 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.79 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 3.7 m-70 -138.27 54.12 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.348 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.828 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.1 t80 -125.04 89.93 3.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.186 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.861 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.2 tt -109.55 142.44 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 111.673 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.63 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 21.6 t80 -130.96 131.55 44.49 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.063 179.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.811 ' CE2' ' HA ' ' A' ' 22' ' ' VAL . 1.2 p90 -154.85 179.27 9.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.152 -179.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.751 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 24.4 t80 -137.91 104.15 5.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.698 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.05 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.3 mm? -58.86 173.74 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.083 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.456 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.15 -44.59 0.17 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.039 -0.6 . . . . 0.0 112.872 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.661 ' O ' ' HG3' ' A' ' 80' ' ' GLN . 9.6 tp-100 -144.8 25.58 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.609 0.242 . . . . 0.0 111.323 -179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.829 HG12 ' H ' ' A' ' 82' ' ' ALA . 13.9 t -146.79 178.04 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.841 0.353 . . . . 0.0 111.111 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.847 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -141.11 154.07 45.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.842 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.847 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -139.26 137.26 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.154 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.001 HD23 HG12 ' A' ' 57' ' ' ILE . 3.0 tp -121.89 81.81 1.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.573 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.999 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -85.87 126.66 34.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.329 -179.616 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.828 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -168.7 125.0 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.497 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.799 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -98.59 -171.27 2.09 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.631 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.544 ' CB ' ' HE1' ' A' ' 55' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-O 121.238 0.542 . . . . 0.0 110.641 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.668 ' HD2' ' HA ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.744 0.307 . . . . 0.0 111.129 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.59 ' C ' HD13 ' B' ' 78' ' ' LEU . 5.9 tppt? -93.51 47.21 1.23 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.091 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.019 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.32 -175.5 3.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.301 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' B' ' 77' ' ' TYR . 69.3 t -141.2 74.03 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.774 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.973 HD11 HD11 ' B' ' 74' ' ' ILE . 1.1 mp -34.1 157.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.074 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.752 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 6.1 mmpt? -146.4 -15.08 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.936 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.493 HD22 ' HA ' ' B' ' 10' ' ' ASN . 0.1 OUTLIER 179.81 102.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.486 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.858 ' HB1' ' NE2' ' B' ' 18' ' ' GLN . . . -130.52 104.54 7.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.899 0.381 . . . . 0.0 111.935 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.604 ' N ' ' O ' ' B' ' 73' ' ' PHE . 4.4 t70 -89.21 30.6 0.95 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.154 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.914 ' SD ' ' HE2' ' B' ' 17' ' ' MET . 28.4 ttp -120.96 156.06 32.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.909 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.76 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.8 OUTLIER -46.98 135.78 9.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.59 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.762 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 10.6 mm-40 -41.36 -69.7 0.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.226 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 18.0 mm-40 -44.99 -37.97 4.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.891 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.914 ' HE2' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -65.64 -33.23 75.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.61 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.886 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.37 -29.48 63.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.103 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.668 ' HA ' ' HD2' ' B' ' 4' ' ' ARG . 6.7 pt20 -75.9 -41.74 51.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 0.0 110.382 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.41 -28.83 62.21 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.887 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.917 ' OG ' HD22 ' B' ' 85' ' ' LEU . 1.8 t -67.6 -44.27 78.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.184 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.882 HG23 ' O ' ' B' ' 18' ' ' GLN . 47.2 t -63.26 -48.51 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.766 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 85.8 mt-10 -55.06 -41.5 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.562 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 75.5 m -64.39 -37.76 88.64 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.368 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.769 ' HB1' HD12 ' B' ' 83' ' ' ILE . . . -67.9 -28.22 67.32 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.645 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 3.0 m -71.67 -43.22 66.4 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.77 178.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 1.2 mt-30 -53.13 -46.62 68.86 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.619 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.717 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -77.22 -20.26 55.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.291 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 1.072 HD21 HG11 ' B' ' 81' ' ' VAL . 6.3 mt -77.19 -32.96 56.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.11 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -89.42 -27.45 20.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.371 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.752 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 41.9 mmtm -83.47 -29.32 28.11 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.917 0.389 . . . . 0.0 110.705 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.752 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -152.68 141.09 20.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.566 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.71 29.39 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.955 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 1.031 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 7.5 mm -103.61 101.28 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.868 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.851 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.9 mp0 -29.83 -68.85 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.629 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -49.48 -56.2 10.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.818 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 1.031 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -49.27 -63.67 1.04 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.679 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.748 ' O ' HG13 ' B' ' 42' ' ' ILE . 38.8 mt -42.38 -46.31 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.935 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.949 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -63.65 -40.64 97.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.925 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.709 ' HA ' ' CE1' ' A' ' 65' ' ' TYR . . . -57.67 -67.15 0.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.967 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.689 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -46.66 -57.31 4.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.728 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.748 HG13 ' O ' ' B' ' 38' ' ' ILE . 78.1 mt -43.59 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.651 ' HB3' ' HE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -36.99 -48.09 0.75 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.325 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.462 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -59.38 -45.3 91.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.549 -179.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.683 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.7 OUTLIER -69.68 -46.9 65.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.359 -179.519 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.825 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -60.85 -33.0 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.979 -179.823 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.781 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.73 -50.2 26.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.721 179.789 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.937 ' HA ' ' HE3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -72.28 -22.36 61.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.683 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -90.45 -26.57 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.703 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 15.2 m-85 -120.02 -65.35 1.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.192 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.703 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 21.7 t-20 160.27 110.19 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.96 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.781 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 81.2 Cg_exo -43.84 149.79 0.68 Allowed 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 122.49 2.127 . . . . 0.0 112.717 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.928 ' CG2' HG21 ' A' ' 67' ' ' THR . 0.2 OUTLIER -125.75 137.92 53.83 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 122.955 0.502 . . . . 0.0 110.549 -0.104 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.772 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 34.2 m95 -95.28 121.5 37.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.828 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.871 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -91.09 97.91 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.437 178.672 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 1.021 ' HB3' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -113.72 143.44 44.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 112.448 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 1.055 HG21 HG21 ' A' ' 57' ' ' ILE . 21.2 mm -130.11 97.21 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.06 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 0.949 HG12 ' HB2' ' B' ' 39' ' ' ALA . 3.3 p -98.48 129.69 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.971 0.415 . . . . 0.0 111.385 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.733 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.96 -144.03 4.09 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.712 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.63 10.71 0.06 Allowed 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.756 0.312 . . . . 0.0 111.111 -179.659 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.519 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 2.2 t-20 175.98 30.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.933 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.932 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 9.5 p90 -102.13 -166.64 1.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.985 0.422 . . . . 0.0 110.976 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.741 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -147.82 86.76 0.16 Allowed Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.919 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.975 ' CB ' HD12 ' A' ' 57' ' ' ILE . 8.3 p -73.28 141.64 47.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.398 . . . . 0.0 111.533 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.837 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 12.1 t80 -147.08 62.34 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.359 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.981 HG13 HD11 ' A' ' 57' ' ' ILE . 21.5 m -102.38 161.31 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' B' ' 69' ' ' GLU . 18.4 m -99.13 94.5 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.846 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.728 ' HA ' ' HD2' ' B' ' 86' ' ' PHE . 0.0 OUTLIER -31.22 -44.48 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.163 -179.853 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' B' ' 68' ' ' HIS . 19.3 pt-20 43.64 36.83 1.33 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.997 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.642 HG22 ' H ' ' B' ' 71' ' ' LYS . 3.0 m -170.16 -136.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.969 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.654 ' O ' ' HA ' ' B' ' 13' ' ' MET . 10.2 mtmm -146.43 12.47 1.19 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.71 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.852 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 8.4 m-70 -119.41 47.59 1.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.678 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.779 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 6.8 t80 -116.47 116.78 28.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.53 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.973 HD11 HD11 ' B' ' 8' ' ' ILE . 0.8 OUTLIER -135.85 125.76 41.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.999 0.428 . . . . 0.0 111.729 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.752 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 16.6 t80 -112.07 136.64 51.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.803 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.949 ' HE1' HG23 ' B' ' 74' ' ' ILE . 2.3 p90 -162.56 164.1 26.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 111.246 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.518 ' O ' ' N ' ' B' ' 7' ' ' VAL . 65.4 t80 -122.52 109.62 14.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.015 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.019 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -70.27 170.37 11.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.629 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.13 -47.03 0.02 OUTLIER Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.191 -0.528 . . . . 0.0 112.932 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.458 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 2.8 mt-30 -149.56 37.18 0.74 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.905 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 1.072 HG11 HD21 ' B' ' 29' ' ' LEU . 85.6 t -154.02 170.84 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.162 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.726 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -137.43 141.72 41.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.866 HD11 HD11 ' B' ' 29' ' ' LEU . 0.2 OUTLIER -128.24 128.6 68.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.07 0.462 . . . . 0.0 111.678 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.899 HD23 ' CG1' ' B' ' 57' ' ' ILE . 1.2 tp -116.31 85.3 2.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.031 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 1.021 HD12 ' HB3' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -93.03 128.94 39.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.573 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.728 ' HD2' ' HA ' ' B' ' 68' ' ' HIS . 1.2 p90 -167.62 123.7 1.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.849 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.772 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 32.7 mtpt -91.59 159.88 15.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.753 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.662 ' H ' ' CE1' ' B' ' 55' ' ' HIS . 32.2 m -105.17 18.31 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.302 0.572 . . . . 0.0 110.799 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.428 -1.207 . . . . 0.0 112.544 -179.962 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.638 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 20.7 tptm . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.828 0.347 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.086 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -135.9 -168.95 2.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.79 ' O ' ' HD2' ' A' ' 9' ' ' LYS . 73.6 t -145.67 72.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.932 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 1.065 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -43.92 162.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.251 0.548 . . . . 0.0 111.09 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.79 ' HD2' ' O ' ' A' ' 7' ' ' VAL . 0.0 OUTLIER -149.82 -22.42 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.343 179.095 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.663 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 54.8 t30 -156.5 165.52 36.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.265 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.666 ' HA ' ' CD1' ' A' ' 73' ' ' PHE . . . 166.54 127.97 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.985 0.422 . . . . 0.0 111.911 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.781 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 2.1 m-20 -118.36 26.93 9.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.872 178.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.899 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 28.6 ttp -108.91 167.04 10.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.823 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.69 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.1 OUTLIER -58.14 129.4 41.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.79 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.701 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 mt-10 -33.74 -66.72 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -50.55 -32.92 19.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.785 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.704 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 39.5 mmm -72.63 -33.72 66.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.17 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.895 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.49 -39.41 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.636 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.641 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 1.8 mt-30 -74.48 -34.3 63.08 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.24 -31.79 66.13 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.848 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.751 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -67.34 -46.45 73.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.18 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.934 HG13 ' CE2' ' A' ' 76' ' ' PHE . 11.8 t -59.67 -45.16 94.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.541 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 43.0 mt-10 -59.64 -37.0 77.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.117 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.646 ' SG ' HG23 ' A' ' 42' ' ' ILE . 11.5 t -66.32 -40.22 89.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.159 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.74 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -67.49 -22.59 65.45 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.688 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 2.3 m -78.85 -46.39 18.72 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.581 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.57 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 7.4 mm100 -48.06 -45.23 32.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.417 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.748 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -77.47 -33.84 54.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.127 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.698 ' CD1' ' HG ' ' A' ' 78' ' ' LEU . 5.5 mt -63.75 -24.02 67.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.055 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -99.43 -28.65 13.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.554 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.805 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 29.5 mmtp -84.87 -27.27 26.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 111.091 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.805 ' CE1' ' HB2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -146.25 161.31 40.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -126.31 36.38 4.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.952 HG22 ' HD3' ' A' ' 36' ' ' LYS . 3.3 mm -120.15 97.43 5.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.829 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.673 ' C ' ' HA3' ' B' ' 63' ' ' GLY . 2.5 mp0 -22.5 -72.71 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.206 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.952 ' HD3' HG22 ' A' ' 34' ' ' ILE . 0.0 OUTLIER -47.62 -51.04 22.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.5 179.617 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.893 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.6 t0 -54.38 -62.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.52 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.754 ' O ' HG13 ' A' ' 42' ' ' ILE . 5.6 mt -43.51 -42.82 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.874 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 1.061 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -65.6 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.902 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.821 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -39.1 -51.39 1.88 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.938 0.399 . . . . 0.0 110.724 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.548 ' CE1' ' CD1' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -64.91 -54.91 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.89 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.762 ' CG2' HD11 ' A' ' 85' ' ' LEU . 83.9 mt -45.72 -56.42 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.098 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.502 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -59.47 -70.9 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.966 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.546 ' HD2' ' C ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -34.1 -59.97 0.41 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.959 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -46.76 84.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.941 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.751 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -59.76 -18.58 44.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.817 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.715 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -87.84 -34.27 18.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.636 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -99.56 6.72 45.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.755 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.97 6.68 8.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.102 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.56 ' CD1' ' HE1' ' A' ' 17' ' ' MET . 95.2 m-85 -149.1 -67.3 0.22 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.738 ' O ' ' HE2' ' A' ' 87' ' ' LYS . 12.3 m-20 160.93 108.52 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.432 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.715 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 92.0 Cg_exo -43.85 155.76 0.19 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.47 2.113 . . . . 0.0 112.437 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.816 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.5 m -117.2 132.61 56.6 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 123.199 0.6 . . . . 0.0 110.485 -0.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.841 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 60.6 m95 -98.81 166.89 11.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.415 0.626 . . . . 0.0 111.951 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.88 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.0 OUTLIER -158.03 109.26 2.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.237 179.269 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.807 ' CB ' HD12 ' A' ' 85' ' ' LEU . 6.2 p -121.96 152.05 40.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.223 0.535 . . . . 0.0 112.425 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.013 HD11 HG13 ' B' ' 66' ' ' VAL . 20.9 mm -129.13 105.93 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.391 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.061 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.6 p -104.13 124.33 58.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.915 0.388 . . . . 0.0 111.675 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.879 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -149.65 -131.45 1.94 Allowed Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.758 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.628 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -160.02 5.64 0.09 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.657 0.265 . . . . 0.0 111.475 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.628 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 41.8 t30 166.7 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.763 0.315 . . . . 0.0 111.312 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.748 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 45.9 p90 -77.5 -178.33 5.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.0 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.62 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.94 76.94 0.39 Allowed Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.177 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.945 ' HA ' HG23 ' B' ' 57' ' ' ILE . 88.6 p -69.98 151.97 44.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.881 0.372 . . . . 0.0 111.354 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.801 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 11.6 t80 -164.22 56.81 0.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.589 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.756 HG11 ' CZ ' ' A' ' 86' ' ' PHE . 6.9 m -80.83 -161.12 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.049 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.781 HG21 ' OG1' ' B' ' 53' ' ' THR . 1.2 m -157.03 96.47 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.221 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.628 ' CD2' ' N ' ' A' ' 69' ' ' GLU . 42.6 t60 -175.68 -97.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.846 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.636 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 0.6 OUTLIER 43.75 75.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.973 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -101.99 -37.27 8.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.984 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.781 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 4.3 ptpt -177.67 12.18 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.941 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.932 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 61.6 m-70 -136.97 23.99 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.822 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.849 ' HD2' ' HB3' ' A' ' 86' ' ' PHE . 14.1 t80 -105.63 168.8 8.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.852 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.895 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.4 tt 171.54 119.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.124 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.426 ' O ' ' HD3' ' A' ' 9' ' ' LYS . 3.5 t80 -116.52 111.33 19.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.809 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 1.065 ' HB3' HG13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -130.98 176.46 8.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.221 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.732 ' CB ' ' HE2' ' A' ' 9' ' ' LYS . 20.2 t80 -135.93 103.97 5.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.756 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.086 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -61.41 177.66 0.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.916 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.83 -42.03 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.46 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.528 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 2.2 pm0 -154.53 43.04 0.5 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.862 0.363 . . . . 0.0 110.829 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.879 HG13 ' O ' ' A' ' 59' ' ' GLY . 55.6 t -154.49 166.85 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.116 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.63 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -134.68 114.48 12.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.673 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.719 HG21 ' HB2' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -105.71 120.4 56.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.998 0.428 . . . . 0.0 111.429 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.0 HD23 HG12 ' A' ' 57' ' ' ILE . 0.3 OUTLIER -105.06 91.78 3.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.316 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.807 HD12 ' CB ' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -95.86 127.11 41.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -179.282 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.849 ' HB3' ' HD2' ' A' ' 73' ' ' PHE . 30.0 p90 -158.06 144.48 17.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.742 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.932 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -105.14 -170.23 1.72 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.957 0.408 . . . . 0.0 110.771 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.88 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.359 0 CA-C-O 121.471 0.653 . . . . 0.0 109.994 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.772 ' HG2' ' CD ' ' B' ' 19' ' ' GLN . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.071 0 CA-C-O 120.877 0.37 . . . . 0.0 110.815 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.676 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.0 OUTLIER -80.44 118.67 22.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.039 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 162.1 -167.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.116 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.675 ' O ' ' HG2' ' B' ' 9' ' ' LYS . 22.7 t -156.67 73.24 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.954 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -47.24 148.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.06 0.457 . . . . 0.0 110.535 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.755 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 2.8 mmtt -154.68 -1.95 0.17 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.324 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.906 ' HB3' ' HB3' ' B' ' 75' ' ' TYR . 0.3 OUTLIER -164.08 70.3 0.2 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.963 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.764 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -110.73 153.81 24.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.133 0.492 . . . . 0.0 111.511 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.6 ' HB3' ' HD2' ' B' ' 68' ' ' HIS . 6.9 t70 -149.85 28.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.015 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.925 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 11.9 ttp -121.48 170.82 9.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.66 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.723 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.3 OUTLIER -57.19 140.86 48.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.716 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.713 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 31.5 mp0 -46.0 -63.39 0.99 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.172 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -28.69 19.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.004 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.925 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 53.4 mmm -79.63 -35.56 39.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.048 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.738 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -71.17 -35.67 71.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.921 0.391 . . . . 0.0 110.315 179.657 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.772 ' CD ' ' HG2' ' B' ' 4' ' ' ARG . 2.6 mm-40 -75.16 -36.56 61.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.182 0.515 . . . . 0.0 109.646 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.552 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 5.4 m-20 -70.35 -29.28 65.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.653 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.844 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -68.92 -49.22 59.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.905 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.819 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 77.6 t -54.28 -45.29 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.139 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 83.6 mt-10 -58.94 -39.6 82.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.878 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' B' ' 42' ' ' ILE . 13.3 t -65.22 -36.23 83.52 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.009 -0.542 . . . . 0.0 109.968 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.776 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -69.26 -29.56 67.49 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.536 ' HA ' HD12 ' B' ' 29' ' ' LEU . 2.0 m -71.45 -37.69 71.36 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.825 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' B' ' 31' ' ' LYS . 43.1 mt-30 -60.72 -42.73 97.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.692 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.939 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -73.42 -27.2 61.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.583 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.776 HD12 ' O ' ' B' ' 25' ' ' ALA . 2.5 mt -72.98 -49.19 30.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.87 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.75 -26.64 63.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.024 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.646 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 2.6 mttp -86.73 -30.32 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.966 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.63 ' HE1' ' ND1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.6 163.91 36.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.005 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.42 27.75 6.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.75 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.695 ' HB ' ' CB ' ' B' ' 37' ' ' ASP . 9.2 mm -108.78 106.39 20.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.797 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.629 ' OE2' ' HA2' ' B' ' 59' ' ' GLY . 2.0 mm-40 -29.78 -71.03 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.452 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -46.82 -48.05 20.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.869 0.366 . . . . 0.0 110.609 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.695 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 14.3 t0 -54.77 -60.81 2.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.648 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.939 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 3.9 mt -48.13 -49.1 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.516 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 1.067 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -56.6 -35.5 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.43 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.801 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -72.04 -63.64 1.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.317 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.741 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -37.47 -56.13 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.14 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.787 HD11 HG22 ' B' ' 38' ' ' ILE . 6.9 mt -56.56 -68.24 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.284 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.644 ' HE3' ' HE2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -38.94 -47.84 1.5 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.827 0.346 . . . . 0.0 111.146 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' B' ' 43' ' ' LYS . 0.4 OUTLIER -61.91 -53.11 60.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.462 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.535 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 1.2 tp10 -60.83 -34.21 74.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.164 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.844 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -67.06 -49.04 66.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.821 0.343 . . . . 0.0 110.606 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.674 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -55.73 -37.66 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.86 -20.2 22.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.383 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 3.0 tttt -88.5 -13.35 40.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 111.18 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.651 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 23.3 m-85 -142.49 -67.54 0.37 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.418 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.651 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 30.8 t-20 160.22 117.32 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.827 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.674 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 10.7 Cg_endo -53.28 168.96 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.442 2.095 . . . . 0.0 112.511 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.781 ' OG1' HG21 ' A' ' 67' ' ' THR . 8.6 t -109.99 122.45 47.61 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 122.833 0.453 . . . . 0.0 110.775 0.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.853 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 48.5 m95 -92.44 120.8 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.704 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.734 ' NE2' HG23 ' B' ' 53' ' ' THR . 0.2 OUTLIER -100.0 105.44 17.11 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.116 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.992 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -130.8 165.28 23.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.52 0.676 . . . . 0.0 112.183 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.988 HD12 HG13 ' A' ' 57' ' ' ILE . 34.3 mt -146.44 165.41 8.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.589 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.067 HG12 ' HB2' ' B' ' 39' ' ' ALA . 1.7 p -155.14 122.35 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 111.596 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.629 ' HA2' ' OE2' ' B' ' 35' ' ' GLU . . . -149.2 -175.02 21.23 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.037 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.646 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.9 OUTLIER -146.3 36.18 1.0 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.218 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.646 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.2 OUTLIER 168.11 26.6 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.121 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.8 ' CE2' ' HB3' ' B' ' 64' ' ' SER . 0.1 OUTLIER -111.48 -166.57 1.09 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.674 ' HA3' ' N ' ' A' ' 36' ' ' LYS . . . -144.8 77.79 0.27 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.843 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 1.006 ' HB2' HD12 ' A' ' 57' ' ' ILE . 18.1 p -70.6 131.77 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.034 0.445 . . . . 0.0 111.531 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.821 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 55.7 t80 -144.76 76.51 1.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.304 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 1.013 HG13 HD11 ' A' ' 57' ' ' ILE . 28.5 m -110.2 167.39 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.235 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.594 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 28.7 m -112.8 134.98 54.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.875 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.6 ' HD2' ' HB3' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -87.36 176.63 7.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.834 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.631 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -162.61 56.81 0.22 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.827 -179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.697 HG23 ' H ' ' B' ' 71' ' ' LYS . 2.0 t 169.37 -108.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.947 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.697 ' H ' HG23 ' B' ' 70' ' ' THR . 0.0 OUTLIER -163.26 28.94 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.606 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.965 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 7.3 m80 -128.75 41.96 3.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.983 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 12.9 t80 -117.59 83.65 2.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.357 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.877 HD11 HD11 ' B' ' 8' ' ' ILE . 0.0 OUTLIER -110.94 109.5 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.922 -179.155 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.906 ' HB3' ' HB3' ' B' ' 10' ' ' ASN . 14.1 t80 -99.33 126.02 45.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.315 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.954 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.7 p90 -142.92 170.24 16.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.007 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.659 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 50.9 t80 -132.9 116.94 17.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.621 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.039 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -69.13 167.64 15.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.679 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -29.12 -46.9 0.08 OUTLIER Glycine 0 C--N 1.329 0.145 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.945 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -143.32 27.63 1.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.684 HG12 ' N ' ' B' ' 82' ' ' ALA . 38.3 t -145.41 171.03 5.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.894 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.844 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -132.34 145.52 51.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.882 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.844 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -142.97 106.42 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.153 -179.741 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.787 HD23 ' HB ' ' B' ' 57' ' ' ILE . 0.2 OUTLIER -97.97 110.17 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.575 179.741 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.992 HD12 ' HB2' ' B' ' 56' ' ' CYS . 2.0 mp -106.88 125.21 50.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.9 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.723 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 0.7 OUTLIER -151.58 119.07 6.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.364 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.965 ' HB2' ' HB2' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -97.01 164.27 12.59 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.758 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.631 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -119.23 18.98 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.341 0.591 . . . . 0.0 110.649 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . 0.482 ' HA2' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.339 -1.256 . . . . 0.0 112.467 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.787 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.617 0.246 . . . . 0.0 110.75 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.049 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 159.15 172.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.693 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.777 ' O ' ' HE2' ' A' ' 9' ' ' LYS . 8.7 t -131.03 69.37 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.924 HD11 HD11 ' A' ' 74' ' ' ILE . 0.9 OUTLIER -33.48 149.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.777 ' HE2' ' O ' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -134.84 -12.71 2.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.8 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 177.51 93.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.638 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.78 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -129.72 104.13 7.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.723 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.54 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 16.8 m-20 -96.01 27.71 3.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.234 0.54 . . . . 0.0 109.866 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.919 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.9 OUTLIER -103.79 168.96 8.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.783 -179.622 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.902 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -51.32 123.59 9.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.466 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -34.86 -69.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.824 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.525 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 32.6 tt0 -52.15 -28.38 17.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.919 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -71.85 -41.6 67.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.856 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.738 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.42 -29.51 69.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.944 0.402 . . . . 0.0 110.331 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.759 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -77.21 -42.32 37.87 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.097 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.759 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -69.29 -28.4 66.25 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.555 178.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.887 ' OG ' HD22 ' A' ' 85' ' ' LEU . 30.0 t -67.11 -51.12 58.07 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.969 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.777 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 94.1 t -54.41 -46.59 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.926 179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -54.34 -43.62 71.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.351 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -39.27 91.76 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.951 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.731 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -69.39 -30.97 69.07 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -70.68 -37.08 73.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.58 178.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.43 HE21 ' HB3' ' A' ' 27' ' ' GLN . 6.0 mt-30 -58.81 -42.4 89.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.928 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -79.84 -23.03 42.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.289 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.731 HD12 ' O ' ' A' ' 25' ' ' ALA . 4.6 mt -81.1 -26.13 36.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.022 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.23 -32.47 15.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.201 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -86.08 -24.94 26.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.783 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.628 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -150.11 155.86 40.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.614 179.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.413 ' HA ' HD11 ' A' ' 38' ' ' ILE . 0.0 OUTLIER -123.54 28.53 6.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.063 0.458 . . . . 0.0 110.735 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.88 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 16.1 mm -106.59 107.54 22.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.942 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.774 ' HB3' ' CA ' ' B' ' 63' ' ' GLY . 0.9 OUTLIER -26.67 -84.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.033 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.01 -47.31 2.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.323 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.88 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -54.75 -63.11 1.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 0.0 111.14 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.928 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 3.2 mt -48.2 -48.21 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.937 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.86 -42.1 92.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.05 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.797 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.4 -64.67 0.77 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.077 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.685 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -52.29 -39.53 60.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.659 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.778 ' CG2' HD11 ' A' ' 85' ' ' LEU . 85.4 mt -58.56 -57.22 11.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.958 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.525 ' HZ2' ' HE2' ' B' ' 65' ' ' TYR . 0.2 OUTLIER -51.57 -60.51 3.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -42.57 -62.23 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.602 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.3 mt-10 -42.98 -67.48 0.27 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.946 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.813 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -44.57 -51.32 9.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.723 ' OD1' ' HB2' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -57.54 -25.02 59.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.087 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -120.97 14.27 11.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.18 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.5 tttp -128.44 1.89 5.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.389 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 72.2 m-85 -152.85 -62.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.185 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.482 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 3.1 m-20 161.24 117.67 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.566 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.583 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 19.1 Cg_endo -60.06 169.18 5.07 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.521 2.147 . . . . 0.0 112.327 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.784 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 88.6 m -104.92 130.58 53.06 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.011 0.525 . . . . 0.0 110.254 -0.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.723 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 69.1 m95 -101.51 170.56 8.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.654 0.74 . . . . 0.0 112.421 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.624 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.3 OUTLIER -162.92 103.64 1.01 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.442 179.495 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.965 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -117.97 156.12 29.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.538 0.685 . . . . 0.0 112.796 -177.667 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.951 ' CG1' HD23 ' A' ' 84' ' ' LEU . 27.0 mm -127.45 157.52 39.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.144 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.937 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.1 p -152.36 112.12 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.888 0.375 . . . . 0.0 111.276 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.502 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -150.75 -155.86 7.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.157 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.49 ' HB2' HH11 ' A' ' 60' ' ' ARG . 0.1 OUTLIER -163.5 34.72 0.09 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 120.76 0.314 . . . . 0.0 111.289 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 171.05 26.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.787 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 24.0 p90 -111.12 179.95 3.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.802 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.873 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -135.4 96.29 0.27 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.321 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.905 ' CA ' HD12 ' B' ' 57' ' ' ILE . 4.7 p -82.03 129.82 34.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.061 0.458 . . . . 0.0 111.54 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.803 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 67.3 t80 -143.49 84.18 1.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.118 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.882 HG13 HD11 ' B' ' 57' ' ' ILE . 4.4 m -135.81 159.85 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.306 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.821 HG22 ' CE1' ' B' ' 55' ' ' HIS . 1.3 t -66.75 -171.98 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.034 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.623 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -129.05 172.69 11.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.011 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.738 ' CG ' ' HA ' ' A' ' 88' ' ' SER . 7.1 mm-40 -163.85 143.85 8.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.885 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.707 HG21 ' NZ ' ' A' ' 87' ' ' LYS . 48.3 m 47.64 -102.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.797 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 19.6 mmtt -74.06 32.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.742 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.752 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 53.7 m-70 48.77 -87.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.752 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 2.3 p90 163.51 156.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.786 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.924 HD11 HD11 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -127.96 106.21 14.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 111.024 179.566 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.743 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 63.4 t80 -106.72 93.82 4.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.856 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -107.69 168.59 9.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.331 -179.534 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.897 ' HD1' ' HB2' ' A' ' 82' ' ' ALA . 76.7 t80 -127.0 87.39 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.716 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.049 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -40.67 167.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.465 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.38 -48.58 0.33 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.759 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.25 20.6 2.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.743 HG12 ' N ' ' A' ' 82' ' ' ALA . 39.9 t -140.7 175.12 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.897 ' HB2' ' HD1' ' A' ' 77' ' ' TYR . . . -137.14 143.45 42.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.661 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.666 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 0.2 OUTLIER -132.45 111.49 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 -179.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.951 HD23 ' CG1' ' A' ' 57' ' ' ILE . 3.9 tp -94.93 88.81 5.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.417 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.965 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -93.65 141.0 28.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.458 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.699 ' HB3' ' HB2' ' A' ' 73' ' ' PHE . 2.8 p90 -176.51 152.23 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.797 ' HZ3' ' HG2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -112.43 -168.46 1.32 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.841 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.738 ' HA ' ' CG ' ' A' ' 69' ' ' GLU . 41.8 m . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.297 0.57 . . . . 0.0 110.517 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.444 ' NH1' ' HB2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.781 0.324 . . . . 0.0 110.89 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.497 ' C ' HD13 ' B' ' 78' ' ' LEU . 0.8 OUTLIER 46.08 31.01 1.04 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.002 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.008 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.79 -177.94 4.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.27 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.904 HG12 ' HE2' ' B' ' 9' ' ' LYS . 72.9 t -141.85 68.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.553 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.884 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -38.58 150.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 -179.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.904 ' HE2' HG12 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -137.92 -15.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.991 179.497 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.5 OUTLIER -175.92 122.73 0.19 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.417 -179.864 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.623 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -149.03 102.08 3.22 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.788 0.328 . . . . 0.0 111.821 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.775 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -84.62 26.79 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.291 0.567 . . . . 0.0 109.857 178.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.876 ' HG2' ' N ' ' B' ' 14' ' ' SER . 0.1 OUTLIER -114.66 166.76 11.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.544 -179.586 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.876 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.3 OUTLIER -55.33 141.37 36.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.744 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.653 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -51.58 -56.59 12.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -28.73 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.686 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.751 ' HA ' ' OD2' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -75.56 -39.51 58.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.851 179.85 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.974 ' O ' HG23 ' B' ' 22' ' ' VAL . 0.0 OUTLIER -66.42 -29.25 69.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.052 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -77.55 -45.15 26.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.095 0.474 . . . . 0.0 109.818 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.751 ' OD2' ' HA ' ' B' ' 17' ' ' MET . 2.2 p30 -70.97 -27.72 63.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.741 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.787 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 96.2 p -68.88 -44.27 73.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.232 179.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.974 HG23 ' O ' ' B' ' 18' ' ' GLN . 40.6 t -62.67 -47.32 93.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.564 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -58.73 -35.05 72.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.69 -37.24 79.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.006 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.728 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -70.08 -31.14 68.57 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.7 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 23.8 m -71.0 -42.34 69.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.295 -1.321 . . . . 0.0 109.505 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.545 ' O ' ' HG3' ' B' ' 30' ' ' GLU . 1.7 mt-30 -51.97 -46.44 64.8 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.316 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.828 ' HB3' HG23 ' B' ' 38' ' ' ILE . . . -77.24 -19.83 56.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.172 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.837 HD11 HD11 ' B' ' 83' ' ' ILE . 5.2 mt -78.71 -25.22 44.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.938 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . 0.545 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 1.2 pt-20 -90.28 -38.39 13.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.172 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.858 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.2 mmtp -77.52 -33.48 54.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.614 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.858 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -143.4 146.38 33.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.812 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.506 ' OD1' HD13 ' B' ' 34' ' ' ILE . 26.2 p30 -113.52 30.22 7.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.925 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 14.6 mm -106.78 105.98 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.676 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.873 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.3 mp0 -29.52 -67.48 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.605 ' HD3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -52.71 -56.96 11.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.886 0.374 . . . . 0.0 110.719 179.625 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.925 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.7 t0 -45.55 -65.43 0.54 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.743 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.828 HG23 ' HB3' ' B' ' 28' ' ' ALA . 8.2 mt -43.76 -58.94 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.114 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 1.035 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -45.96 -52.83 11.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.952 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.803 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -47.84 -66.11 0.46 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.967 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.58 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -45.86 -43.64 13.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.942 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.728 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 67.1 mt -54.85 -62.84 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.79 ' HB3' ' CE2' ' A' ' 65' ' ' TYR . 12.0 tttm -50.48 -37.28 37.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.752 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' B' ' 48' ' ' LYS . 0.3 OUTLIER -64.2 -46.99 81.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.093 -179.811 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.726 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 26.3 tt0 -73.25 -28.83 62.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.787 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -77.49 -36.17 52.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.768 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 4.0 m-20 -74.92 -30.49 61.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.098 0.475 . . . . 0.0 110.221 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.427 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -87.08 -40.78 14.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.753 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.726 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.9 ttmt -76.6 -27.34 55.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 -179.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.556 ' CD2' ' HE1' ' B' ' 17' ' ' MET . 16.7 m-85 -121.02 -68.52 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.339 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.497 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER 155.86 119.47 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 -179.523 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.768 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 19.7 Cg_endo -58.53 168.31 4.16 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 122.375 2.05 . . . . 0.0 112.645 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.623 HG21 HG21 ' A' ' 67' ' ' THR . 15.1 t -106.91 133.16 51.99 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.229 0.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.89 ' NE1' ' HE3' ' B' ' 87' ' ' LYS . 39.5 m95 -103.86 110.14 22.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.418 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.821 ' CE1' HG22 ' A' ' 67' ' ' THR . 3.5 m170 -82.57 95.62 7.82 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.678 ' O ' HD13 ' B' ' 57' ' ' ILE . 24.5 p -110.43 133.93 52.81 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.949 ' CG1' HD23 ' B' ' 84' ' ' LEU . 17.6 mm -125.15 115.23 43.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.704 178.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.035 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -116.87 119.13 61.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.024 0.44 . . . . 0.0 111.691 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.805 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -137.17 -125.98 2.47 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.809 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 0.7 OUTLIER -165.15 -6.1 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.671 0.272 . . . . 0.0 111.464 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 14.2 t-20 179.26 37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.856 0.36 . . . . 0.0 111.077 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.787 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.4 p90 -88.62 179.85 6.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.774 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -125.28 74.98 0.4 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.981 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.866 ' HA ' HG23 ' A' ' 57' ' ' ILE . 65.4 p -71.26 135.26 47.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.965 0.412 . . . . 0.0 111.514 -179.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.877 ' H ' HD13 ' A' ' 57' ' ' ILE . 18.4 t80 -146.83 71.16 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.458 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.854 HG21 ' CD2' ' B' ' 86' ' ' PHE . 17.9 m -104.59 163.73 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.097 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.617 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 20.0 m -103.02 103.94 14.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.15 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.545 ' HD2' ' CB ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -70.74 -158.36 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.535 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.4 OUTLIER 177.33 -87.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.056 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.5 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 2.0 m -37.97 -99.2 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.281 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.599 ' NZ ' ' HB3' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 179.16 44.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.903 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.698 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 36.6 m80 -135.48 42.52 2.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.877 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.775 ' HD1' ' H ' ' B' ' 12' ' ' ASP . 2.7 t80 -113.6 106.83 14.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.419 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.837 HG23 ' HE1' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -121.81 144.83 29.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.641 -179.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -133.95 133.35 41.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.006 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.884 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.08 163.55 36.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.577 -179.344 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.684 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 11.5 t80 -120.79 105.25 10.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.737 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.008 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.3 mm? -69.86 170.77 10.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.605 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.73 -35.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.898 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.599 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -159.54 43.41 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.787 0.327 . . . . 0.0 110.854 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.805 HG13 ' O ' ' B' ' 59' ' ' GLY . 54.2 t -158.92 167.1 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.235 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.614 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -140.8 101.14 4.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.707 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.837 HD11 HD11 ' B' ' 29' ' ' LEU . 0.3 OUTLIER -84.61 150.06 4.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.374 -179.64 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.949 HD23 ' CG1' ' B' ' 57' ' ' ILE . 1.6 tp -135.64 84.88 2.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.716 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -87.91 137.46 32.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 110.948 179.816 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.854 ' CD2' HG21 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -171.64 124.23 0.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.897 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.89 ' HE3' ' NE1' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -96.62 149.35 21.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.799 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -109.97 20.41 17.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.302 0.572 . . . . 0.0 110.566 179.809 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.429 -1.206 . . . . 0.0 112.508 -179.987 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.783 0.325 . . . . 0.0 111.378 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.097 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.18 -169.61 2.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.217 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 77' ' ' TYR . 15.1 t -147.89 72.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.87 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.806 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.9 135.82 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.029 0.442 . . . . 0.0 110.355 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' HG12 ' A' ' 7' ' ' VAL . 8.5 mmpt? -113.59 -18.59 11.89 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.544 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.64 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 0.7 OUTLIER -176.06 158.62 2.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.682 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 169.03 138.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.998 0.427 . . . . 0.0 111.685 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.791 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER -123.65 28.96 6.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.464 179.461 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.728 ' HG3' ' H ' ' A' ' 14' ' ' SER . 15.8 ttp -104.44 170.44 7.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.842 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.728 ' H ' ' HG3' ' A' ' 13' ' ' MET . 22.7 t -56.41 129.35 40.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.699 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.667 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.0 mm-40 -36.72 -67.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -48.58 -29.51 4.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.802 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.652 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.54 -31.91 62.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.791 179.799 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.979 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -72.83 -39.07 66.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.586 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.609 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 93.0 mt-30 -77.46 -34.09 54.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.763 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.0 OUTLIER -71.49 -36.25 71.07 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.603 179.12 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.999 ' HB2' HD22 ' A' ' 85' ' ' LEU . 1.2 p -64.34 -50.15 68.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.942 179.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.954 HG23 ' O ' ' A' ' 18' ' ' GLN . 16.4 t -54.98 -45.15 76.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.338 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.673 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 11.8 mt-10 -56.07 -41.05 74.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.35 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.63 -39.44 93.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.141 0.496 . . . . 0.0 110.027 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.769 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.22 -30.89 69.15 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.543 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -70.75 -36.95 73.37 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.498 178.543 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 22.2 mt-30 -59.52 -41.62 90.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.478 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.927 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -83.04 -22.57 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.688 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.737 HD12 ' C ' ' A' ' 25' ' ' ALA . 4.3 mt -76.28 -36.13 58.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.992 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.08 -29.65 19.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.837 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.667 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 20.6 mttt -83.63 -20.84 32.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.627 ' CG ' ' HE1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -146.31 -172.52 3.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.586 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.09 27.48 0.36 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.103 0.478 . . . . 0.0 110.542 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.064 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 18.9 mm -114.57 104.64 17.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.772 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 3.5 mp0 -25.39 -77.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.393 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.501 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -46.17 -45.14 16.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.193 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 1.064 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -57.97 -60.14 4.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.936 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.927 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 4.3 mt -51.75 -54.78 11.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.985 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 1.041 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -53.78 -39.38 65.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.043 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.754 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.9 -63.12 1.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.123 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.692 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -54.76 -49.03 71.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.822 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.822 ' CG2' HD11 ' A' ' 85' ' ' LEU . 73.3 mt -44.39 -58.85 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.091 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.736 ' HE3' ' CE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -60.26 -61.61 2.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.682 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.569 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 10.6 mttt -36.71 -66.31 0.23 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.004 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.751 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mm-40 -49.16 -42.6 40.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.91 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -61.9 -42.71 99.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.165 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.733 ' HA ' ' CD1' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -65.55 -24.11 67.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.845 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.92 8.92 16.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.461 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.751 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 7.4 tttm -118.17 -1.52 11.35 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.718 ' CE1' ' HB3' ' A' ' 49' ' ' LYS . 10.9 m-85 -150.52 -62.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.363 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.695 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 17.3 t-20 164.82 115.46 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.291 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.723 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 18.9 Cg_endo -60.03 168.82 5.45 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.339 2.026 . . . . 0.0 112.593 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.789 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.9 m -101.82 137.34 40.25 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 110.3 0.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.84 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 76.5 m95 -106.12 140.42 39.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.517 0.675 . . . . 0.0 112.039 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.883 ' HE2' ' HB2' ' A' ' 88' ' ' SER . 0.4 OUTLIER -132.18 107.82 8.86 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.923 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 1.027 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -127.87 175.08 8.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.388 0.614 . . . . 0.0 112.198 -177.922 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.922 HG12 ' HA ' ' B' ' 64' ' ' SER . 60.8 mt -155.39 165.1 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.713 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.041 HG12 ' HB2' ' A' ' 39' ' ' ALA . 7.5 p -151.55 119.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.942 0.401 . . . . 0.0 110.984 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.479 ' O ' ' N ' ' A' ' 82' ' ' ALA . . . -143.91 -174.49 16.22 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.113 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.802 ' HG3' HH11 ' A' ' 60' ' ' ARG . 0.4 OUTLIER -150.88 30.06 0.65 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.825 0.345 . . . . 0.0 111.014 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.694 ' ND2' ' NH1' ' B' ' 60' ' ' ARG . 0.7 OUTLIER 172.14 27.5 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.793 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -111.07 -168.21 1.27 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.738 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -142.13 78.59 0.28 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.855 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.807 ' HA ' HG23 ' B' ' 57' ' ' ILE . 5.8 p -72.23 128.54 35.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.992 0.425 . . . . 0.0 111.231 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.871 ' H ' HD13 ' B' ' 57' ' ' ILE . 33.0 t80 -143.45 83.59 1.78 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.415 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.014 HG13 HD11 ' B' ' 57' ' ' ILE . 2.9 m -127.42 155.85 38.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.453 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.825 HG22 ' NE2' ' B' ' 55' ' ' HIS . 1.2 t -63.75 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.488 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.804 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -148.02 112.76 5.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.847 0.356 . . . . 0.0 111.198 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.738 ' CB ' ' HA ' ' A' ' 88' ' ' SER . 38.9 mm-40 -97.43 174.08 6.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.747 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.547 ' C ' ' H ' ' A' ' 72' ' ' HIS . 0.2 OUTLIER 38.02 -119.19 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.688 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.43 ' H ' ' HB ' ' A' ' 70' ' ' THR . 3.1 mttt -71.16 30.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.904 0.383 . . . . 0.0 110.832 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.804 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 15.5 m-70 68.91 -88.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.008 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.793 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 162.55 -163.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.752 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.979 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.2 OUTLIER -169.64 111.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.617 179.515 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.445 ' CE1' ' OG ' ' A' ' 64' ' ' SER . 40.0 t80 -105.38 129.21 53.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.309 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.806 ' HB3' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -141.77 178.73 7.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.203 -179.849 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.847 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 5.3 t80 -140.18 102.75 4.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.097 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -67.88 -176.0 0.62 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.922 0.391 . . . . 0.0 111.043 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.545 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -55.82 88.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.278 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.631 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 2.5 mp0 80.07 10.64 1.23 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.777 0.322 . . . . 0.0 110.863 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.838 HG12 ' H ' ' A' ' 82' ' ' ALA . 4.4 t -136.22 177.49 6.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.248 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.969 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -148.55 159.7 43.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.969 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.5 OUTLIER -146.21 117.23 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.915 0.388 . . . . 0.0 111.707 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.948 HD21 ' HE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -99.64 100.02 10.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.301 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 1.027 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.5 OUTLIER -103.2 130.98 50.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.948 ' HE2' HD21 ' A' ' 84' ' ' LEU . 34.3 p90 -166.89 131.79 2.08 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.773 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.84 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 34.6 mtpt -86.2 -163.2 0.85 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.837 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.883 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 2.8 m . . . . . 0 C--N 1.33 -0.251 0 CA-C-O 121.372 0.606 . . . . 0.0 110.366 179.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.832 ' N ' ' HD2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.826 0.346 . . . . 0.0 110.912 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.632 ' HA ' ' CE ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 42.61 28.06 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.599 -179.822 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.097 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.15 -164.71 1.35 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.932 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 77' ' ' TYR . 14.7 t -151.5 75.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.126 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.904 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -40.11 156.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.59 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.642 ' HE3' ' HB3' ' B' ' 77' ' ' TYR . 0.0 OUTLIER -151.9 -8.84 0.21 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.526 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.589 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 0.1 OUTLIER -164.58 73.59 0.24 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.459 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.76 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -118.04 113.37 21.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.485 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.708 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 1.4 m-20 -114.29 32.58 5.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.379 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.887 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.0 OUTLIER -116.65 170.02 8.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.677 -179.68 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.882 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -49.32 129.59 18.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.627 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 47.8 mt-10 -38.32 -70.43 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.035 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.483 ' H ' ' HG2' ' B' ' 16' ' ' GLU . 3.3 mm-40 -48.64 -31.99 7.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.887 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -69.97 -38.59 76.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.883 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -67.31 -38.43 84.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.746 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.747 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 7.3 mm-40 -73.92 -35.83 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.772 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.612 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.5 OUTLIER -72.46 -30.81 64.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.806 179.189 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.794 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.4 OUTLIER -68.61 -42.36 78.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.294 179.487 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.827 HG23 ' O ' ' B' ' 18' ' ' GLN . 12.5 t -66.95 -38.04 80.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.438 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.747 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 18.8 mt-10 -63.78 -39.11 93.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.081 179.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 73.0 m -68.72 -34.25 75.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.915 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.844 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -73.14 -33.77 65.69 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.761 ' HA ' HD12 ' B' ' 29' ' ' LEU . 53.8 m -70.53 -38.43 74.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.296 178.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.407 ' HB3' ' CE1' ' B' ' 41' ' ' HIS . 10.7 mt-30 -58.52 -42.06 86.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.356 178.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.922 ' HB2' ' CD2' ' B' ' 41' ' ' HIS . . . -67.67 -35.85 79.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.133 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.844 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.1 mt -64.1 -38.86 92.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -30.62 59.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.175 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.545 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 1.0 OUTLIER -82.93 -29.48 29.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.875 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.564 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.75 169.04 21.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.629 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.694 ' C ' HD13 ' B' ' 34' ' ' ILE . 11.3 t30 -129.09 30.51 5.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.124 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 1.021 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.8 mm -116.73 106.29 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.918 ' HA ' HD12 ' B' ' 38' ' ' ILE . 1.1 mp0 -29.61 -70.35 0.05 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.769 0.318 . . . . 0.0 110.667 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.402 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -44.12 -43.95 7.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.589 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 1.021 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -64.06 -59.56 4.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.451 179.634 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 1.026 ' HB ' HG11 ' B' ' 58' ' ' VAL . 1.0 OUTLIER -45.35 -53.74 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.665 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.956 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.83 -49.11 50.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.821 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -53.86 -68.23 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.922 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.2 OUTLIER -37.59 -40.92 0.43 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.45 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.873 HG21 HD11 ' B' ' 85' ' ' LEU . 56.9 mt -68.15 -67.66 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.555 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.674 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 6.0 tttp -39.87 -53.42 2.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.267 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.641 ' HE2' ' OH ' ' A' ' 65' ' ' TYR . 23.7 mttm -60.33 -43.98 95.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.415 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.77 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 50.0 tp10 -62.12 -37.2 84.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.296 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.794 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.36 -34.95 73.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.118 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.726 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.3 OUTLIER -68.73 -35.49 77.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.807 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.58 -23.52 21.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.138 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.77 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.97 -26.43 21.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.643 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 1.4 m-85 -127.94 -62.45 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.171 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.686 HD22 ' N ' ' B' ' 51' ' ' ASN . 0.0 OUTLIER 154.96 117.12 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.828 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.726 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 10.8 Cg_endo -53.92 169.45 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 122.351 2.034 . . . . 0.0 112.191 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.589 HG21 ' HB ' ' A' ' 67' ' ' THR . 5.8 m -111.37 124.92 53.24 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 122.866 0.467 . . . . 0.0 110.705 0.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.678 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 33.6 m95 -97.53 146.75 24.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.723 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.825 ' NE2' HG22 ' A' ' 67' ' ' THR . 10.5 m170 -111.07 98.79 7.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.108 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.626 ' O ' ' HB1' ' B' ' 39' ' ' ALA . 43.6 t -103.58 124.05 48.08 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -177.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 1.014 HD11 HG13 ' A' ' 66' ' ' VAL . 21.2 mm -121.92 102.54 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.127 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.026 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.6 p -107.24 121.87 60.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.678 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.733 ' O ' ' HB3' ' B' ' 60' ' ' ARG . . . -146.64 -97.24 0.2 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.05 -0.595 . . . . 0.0 111.773 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.733 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 7.8 ptt180 167.59 -27.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -158.6 46.69 0.32 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.667 0.27 . . . . 0.0 111.407 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.793 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 14.8 p90 -96.37 175.41 6.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.659 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.646 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -117.0 83.94 0.36 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.947 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.922 ' HA ' HG12 ' A' ' 57' ' ' ILE . 0.3 OUTLIER -75.73 133.12 40.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 111.432 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.868 ' H ' HG12 ' A' ' 57' ' ' ILE . 22.4 t80 -142.45 61.08 1.44 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.199 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.774 ' HB ' ' CZ ' ' B' ' 86' ' ' PHE . 33.2 m -108.6 168.65 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.678 -179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.515 ' O ' ' CE1' ' A' ' 55' ' ' HIS . 81.8 m -130.72 107.7 9.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.93 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.805 ' CE1' ' HG3' ' B' ' 87' ' ' LYS . 2.3 t-80 -63.92 -143.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.644 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER 171.21 15.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.668 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.899 HG21 ' NZ ' ' B' ' 87' ' ' LYS . 98.0 m -141.97 -96.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.082 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.846 ' HG2' ' HG3' ' B' ' 13' ' ' MET . 0.0 OUTLIER -87.31 14.69 7.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.268 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.708 ' CG ' ' HB3' ' B' ' 12' ' ' ASP . 47.7 m80 76.99 -78.84 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.722 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 12.4 p90 156.5 -169.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.34 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.929 HG23 ' HE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -157.35 114.11 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.021 0.439 . . . . 0.0 111.617 179.804 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.616 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 0.1 OUTLIER -102.27 137.24 40.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.236 179.435 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.929 ' HE1' HG23 ' B' ' 74' ' ' ILE . 0.4 OUTLIER -160.64 159.22 30.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.916 0.389 . . . . 0.0 111.307 -179.821 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.642 ' HB3' ' HE3' ' B' ' 9' ' ' LYS . 7.8 t80 -125.07 112.59 16.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.097 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -71.65 170.5 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.489 179.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.543 ' O ' ' HG3' ' B' ' 80' ' ' GLN . . . -24.44 -40.18 0.01 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 121.211 -0.518 . . . . 0.0 113.037 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' B' ' 78' ' ' LEU . 27.2 mt-30 -157.56 40.1 0.29 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.867 0.365 . . . . 0.0 110.803 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.729 HG13 ' O ' ' B' ' 59' ' ' GLY . 98.6 t -154.73 169.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.123 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.842 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -132.36 151.96 51.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.331 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.842 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.2 OUTLIER -140.09 134.55 36.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.076 0.465 . . . . 0.0 111.589 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.938 HD23 ' CG1' ' B' ' 57' ' ' ILE . 0.3 OUTLIER -123.84 97.61 5.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.108 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.873 HD11 HG21 ' B' ' 42' ' ' ILE . 0.5 OUTLIER -100.85 131.62 46.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.975 0.417 . . . . 0.0 111.541 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.774 ' CZ ' ' HB ' ' B' ' 66' ' ' VAL . 0.4 OUTLIER -172.34 123.97 0.49 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.586 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.899 ' NZ ' HG21 ' B' ' 70' ' ' THR . 0.0 OUTLIER -82.29 161.82 22.5 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.779 0.323 . . . . 0.0 110.721 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.687 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -107.57 19.12 20.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.231 0.538 . . . . 0.0 110.767 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . 0.473 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.427 -1.207 . . . . 0.0 112.412 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.517 ' HE3' ' HA ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.886 0.374 . . . . 0.0 110.838 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.13 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.5 173.9 9.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.369 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.921 HG12 ' HE3' ' A' ' 9' ' ' LYS . 47.9 t -123.92 71.49 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.726 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.992 HD11 HD11 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -41.37 162.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.077 -179.745 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.921 ' HE3' HG12 ' A' ' 7' ' ' VAL . 2.5 mmtt -155.12 -11.3 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -176.22 94.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.616 -179.859 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.903 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.32 84.95 2.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.637 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.746 ' H ' ' HD1' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -73.79 34.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.01 0.433 . . . . 0.0 110.407 179.4 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.886 ' H ' HE22 ' A' ' 18' ' ' GLN . 12.1 ttp -127.69 170.4 12.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.948 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.768 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.3 OUTLIER -61.91 128.8 37.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.837 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.741 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -34.07 -78.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.15 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.439 ' OE1' ' HG2' ' A' ' 17' ' ' MET . 0.0 OUTLIER -37.21 -35.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.993 -179.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.659 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -70.87 -41.6 71.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.166 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.886 HE22 ' H ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -66.91 -35.33 79.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.604 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 4.1 mm100 -73.99 -37.92 64.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.139 0.495 . . . . 0.0 109.812 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.25 -31.02 62.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.022 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.777 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -67.8 -40.77 83.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.242 179.308 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.8 HG22 ' CE2' ' A' ' 76' ' ' PHE . 64.0 t -65.52 -50.8 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.604 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 13.3 mt-10 -53.61 -38.79 64.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -37.13 76.59 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.791 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.743 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -68.09 -25.12 65.16 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.592 ' HA ' HD12 ' A' ' 29' ' ' LEU . 4.2 m -74.93 -45.31 43.29 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.043 -1.435 . . . . 0.0 109.784 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.752 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 53.8 mt-30 -51.82 -47.37 64.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.85 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.782 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -74.42 -26.36 60.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.199 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.937 HD21 HG11 ' A' ' 81' ' ' VAL . 6.6 mt -67.15 -43.58 81.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.14 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -94.13 -10.84 31.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.12 -179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.755 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 3.7 mttp -85.01 -21.75 29.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 110.588 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.755 ' CE1' ' HB3' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -148.57 -54.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.452 179.374 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.717 ' C ' HD12 ' A' ' 34' ' ' ILE . 1.8 t30 80.38 26.78 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.385 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.79 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -111.69 91.03 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.851 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.711 ' HG2' ' HA2' ' A' ' 59' ' ' GLY . 3.1 mp0 -14.05 -85.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 O-C-N 123.603 0.564 . . . . 0.0 111.685 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.49 -49.97 2.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.816 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.79 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -57.6 -60.1 4.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.641 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.866 HG22 HD11 ' A' ' 42' ' ' ILE . 51.7 mt -44.43 -51.86 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.91 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -55.9 -38.9 70.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.005 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.774 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -60.41 -66.36 0.54 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.868 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.641 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -50.86 -49.68 58.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.866 HD11 HG22 ' A' ' 38' ' ' ILE . 94.2 mt -50.24 -52.83 13.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.032 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.913 ' HE3' ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -61.75 -70.2 0.2 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.774 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -30.99 -50.31 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' A' ' 49' ' ' LYS . 3.6 mt-10 -63.84 -67.1 0.46 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.795 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.777 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -40.16 -39.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.783 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.751 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 9.8 t70 -68.29 -42.57 79.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.027 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -99.0 9.54 43.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.166 -179.789 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.56 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -117.32 -23.58 7.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.124 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.766 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 84.4 m-85 -120.79 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.272 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.766 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 13.7 t30 162.68 111.81 0.01 OUTLIER Pre-proline 0 N--CA 1.454 -0.245 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.094 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.751 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 81.8 Cg_exo -44.92 156.39 0.25 Allowed 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.372 2.048 . . . . 0.0 112.378 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.685 ' HA ' ' OD1' ' A' ' 47' ' ' ASP . 6.8 m -112.46 138.64 48.92 Favored 'General case' 0 C--N 1.345 0.41 0 C-N-CA 123.037 0.535 . . . . 0.0 110.511 -0.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.805 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 70.8 m95 -108.43 140.87 41.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.446 0.641 . . . . 0.0 112.488 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.885 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.1 OUTLIER -135.13 104.41 5.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.836 178.631 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.913 ' HB3' ' HE3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -120.91 165.64 14.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.557 0.694 . . . . 0.0 112.79 -177.676 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.055 HG13 HD23 ' A' ' 84' ' ' LEU . 17.4 mm -132.51 165.21 32.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.601 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.6 p -162.47 108.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.918 0.39 . . . . 0.0 111.541 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.779 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -141.83 -114.62 1.08 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.728 ' HB3' ' O ' ' A' ' 59' ' ' GLY . 0.7 OUTLIER 166.68 -12.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.636 0.255 . . . . 0.0 111.657 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -157.78 40.27 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.672 0.272 . . . . 0.0 111.128 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 1.022 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -106.69 -169.5 1.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.951 0.405 . . . . 0.0 111.021 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.892 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.59 86.4 0.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.974 ' HB2' HD22 ' A' ' 84' ' ' LEU . 70.6 p -81.19 129.23 34.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.209 0.528 . . . . 0.0 111.779 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.782 ' H ' HD13 ' B' ' 57' ' ' ILE . 15.7 t80 -137.65 70.65 1.39 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.067 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.001 HG13 HD11 ' B' ' 57' ' ' ILE . 3.4 m -100.56 166.62 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.709 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.714 HG21 ' OG1' ' B' ' 53' ' ' THR . 1.4 m -114.32 68.53 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.57 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.5 ' NE2' ' CB ' ' A' ' 12' ' ' ASP . 37.0 p-80 -62.85 -167.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.571 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.511 ' HB2' ' H ' ' A' ' 70' ' ' THR . 0.7 OUTLIER -176.15 -140.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.786 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.515 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER 36.76 -99.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.265 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.748 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 175.1 27.04 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.893 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.717 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 98.4 m-70 -119.4 49.14 1.39 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.435 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.746 ' HD1' ' H ' ' A' ' 12' ' ' ASP . 0.3 OUTLIER -128.15 126.44 41.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 -179.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.992 HD11 HD11 ' A' ' 8' ' ' ILE . 1.4 tt -134.72 137.48 50.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.997 0.427 . . . . 0.0 111.342 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 10' ' ' ASN . 16.8 t80 -124.06 129.67 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.036 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.971 ' HE1' HG23 ' A' ' 74' ' ' ILE . 0.5 OUTLIER -159.1 167.7 28.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.01 0.433 . . . . 0.0 111.358 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.661 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 28.2 t80 -131.21 93.29 3.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.546 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.13 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -48.87 175.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.957 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -29.66 -54.27 0.19 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.665 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.41 32.65 1.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.865 0.364 . . . . 0.0 110.961 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.937 HG11 HD21 ' A' ' 29' ' ' LEU . 60.1 t -146.49 170.85 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.056 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.924 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -131.48 153.43 49.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.713 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.924 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -144.27 121.57 5.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.925 0.393 . . . . 0.0 111.42 -179.786 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.055 HD23 HG13 ' A' ' 57' ' ' ILE . 3.2 tp -112.41 90.74 3.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.317 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.774 ' HG ' ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -94.76 146.21 24.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.87 -179.32 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.728 ' HB3' ' HD2' ' A' ' 73' ' ' PHE . 7.8 p90 177.21 140.56 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.936 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.851 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 6.4 mtpm? -99.18 -179.03 4.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.987 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.885 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-O 121.265 0.555 . . . . 0.0 110.723 179.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.724 HH22 HD13 ' B' ' 8' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.771 0.32 . . . . 0.0 111.009 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' B' ' 5' ' ' LYS . 11.1 mmmt 39.45 28.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.531 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.006 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.44 -167.47 1.77 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.067 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.694 ' O ' ' HE2' ' B' ' 9' ' ' LYS . 75.7 t -152.88 74.33 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.972 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.815 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -42.84 159.78 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.236 0.541 . . . . 0.0 110.861 -179.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.694 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 5.7 mmtt -152.15 -14.73 0.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.896 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.579 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.9 OUTLIER -171.4 108.69 0.27 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.778 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.784 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -141.61 102.77 4.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.876 0.37 . . . . 0.0 111.653 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.792 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 1.7 t70 -85.77 26.28 0.99 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.439 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.884 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 11.0 ttp -114.89 157.53 23.2 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.743 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.745 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -46.24 152.6 0.4 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.619 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.68 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 2.5 mt-10 -56.48 -70.27 0.12 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.127 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.463 ' HA ' ' HG2' ' B' ' 19' ' ' GLN . 0.8 OUTLIER -49.58 -25.67 2.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.989 0.423 . . . . 0.0 110.533 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.797 ' HE2' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -74.3 -41.9 60.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.828 179.796 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.832 ' O ' HG23 ' B' ' 22' ' ' VAL . 0.0 OUTLIER -68.47 -25.37 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.68 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.702 ' HG3' ' N ' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -78.46 -39.98 36.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.016 179.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.702 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 0.3 OUTLIER -72.96 -24.4 60.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.053 179.213 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.793 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -74.4 -48.04 30.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.27 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.848 HG13 ' CE2' ' B' ' 76' ' ' PHE . 37.4 t -61.91 -39.76 84.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.463 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.527 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 68.7 mt-10 -66.12 -38.81 89.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.067 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' B' ' 20' ' ' ASP . 99.2 m -67.62 -35.25 78.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.712 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.76 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -69.49 -35.8 75.9 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 178.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.819 ' HA ' HD12 ' B' ' 29' ' ' LEU . 88.2 m -65.05 -42.12 94.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.522 178.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 32.5 mt-30 -54.35 -46.81 73.05 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.585 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.78 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -74.01 -16.89 61.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.186 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' B' ' 26' ' ' THR . 3.3 mt -80.66 -41.33 23.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.107 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -78.75 -30.22 45.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.799 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.681 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 7.8 mmtp -84.4 -19.46 33.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.623 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.681 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -158.34 149.89 21.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.813 179.679 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.31 27.45 9.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.7 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 1.017 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.3 mm -108.43 106.42 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.928 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.892 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 35.7 mp0 -30.24 -70.71 0.05 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.527 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.33 -60.31 2.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.691 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 1.017 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.1 OUTLIER -44.48 -65.41 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.55 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.78 HG23 ' CB ' ' B' ' 28' ' ' ALA . 10.9 mt -46.64 -45.12 7.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.325 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -61.99 -43.77 98.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.394 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.531 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -60.82 -64.86 0.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.689 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -42.37 -56.14 3.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.76 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 55.7 mt -46.82 -68.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.637 ' HD3' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -36.45 -57.15 0.77 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.265 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -52.61 -39.74 61.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.462 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.593 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -73.53 -41.88 62.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.196 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.793 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.9 -37.39 87.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.74 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.858 ' HB3' ' HG3' ' B' ' 52' ' ' PRO . 8.0 m-20 -68.32 -46.24 70.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' B' ' 48' ' ' LYS . 22.0 mmmt -79.19 -25.11 42.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.6 tttm -90.16 -12.44 38.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.155 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.55 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 86.0 m-85 -133.39 -71.43 0.51 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.344 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.9 m-20 157.85 107.46 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.069 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.858 ' HG3' ' HB3' ' B' ' 47' ' ' ASP . 72.0 Cg_exo -35.58 156.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.52 2.147 . . . . 0.0 112.691 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.735 HG23 ' CE1' ' B' ' 55' ' ' HIS . 4.7 t -120.94 123.26 42.04 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 123.016 0.527 . . . . 0.0 111.006 -0.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.962 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 37.6 m95 -92.79 118.99 31.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.915 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.812 ' HE2' ' HB2' ' B' ' 88' ' ' SER . 1.9 m-70 -99.54 99.39 10.26 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.764 ' CB ' HD12 ' B' ' 85' ' ' LEU . 24.4 p -114.96 146.39 41.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.264 0.554 . . . . 0.0 112.471 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 1.001 HD11 HG13 ' A' ' 66' ' ' VAL . 22.7 mm -128.19 111.51 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.184 178.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -111.11 135.24 50.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.877 0.37 . . . . 0.0 111.634 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.594 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -165.22 -137.52 2.22 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.967 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.449 ' O ' ' CB ' ' B' ' 61' ' ' ASN . 0.1 OUTLIER -172.33 34.07 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 120.775 0.321 . . . . 0.0 111.269 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.449 ' CB ' ' O ' ' B' ' 60' ' ' ARG . 0.9 OUTLIER 163.81 27.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.776 179.815 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 1.022 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.7 p90 -100.67 165.81 11.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.661 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -121.12 84.29 0.37 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.976 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.905 ' CB ' HD22 ' B' ' 84' ' ' LEU . 3.0 p -79.76 139.27 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.006 0.432 . . . . 0.0 111.444 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.82 ' H ' HD13 ' A' ' 57' ' ' ILE . 4.1 t80 -149.17 64.18 1.03 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.446 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.703 ' HA ' ' HB3' ' A' ' 55' ' ' HIS . 24.3 m -101.78 140.79 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.532 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 17.4 m -85.33 95.43 9.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.612 ' HB3' ' CG ' ' B' ' 73' ' ' PHE . 14.8 p-80 -57.52 -150.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.809 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.727 ' O ' HG22 ' B' ' 70' ' ' THR . 0.0 OUTLIER 168.73 116.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 1.092 HG23 ' HG2' ' B' ' 71' ' ' LYS . 0.5 OUTLIER 81.01 -59.4 0.26 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.476 179.625 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 1.092 ' HG2' HG23 ' B' ' 70' ' ' THR . 0.0 OUTLIER 174.53 -158.44 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.874 -179.756 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.884 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 29.7 m170 64.1 17.77 10.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.855 ' HA ' ' HA ' ' B' ' 86' ' ' PHE . 4.0 t80 -114.26 77.36 1.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.478 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.789 HD13 ' CE1' ' B' ' 76' ' ' PHE . 1.6 tt -96.0 149.05 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.126 0.489 . . . . 0.0 111.469 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.579 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.3 OUTLIER -140.79 125.5 18.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.619 179.145 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.848 ' CE2' HG13 ' B' ' 22' ' ' VAL . 4.5 p90 -155.3 167.38 30.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.975 0.417 . . . . 0.0 111.24 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 10.9 t80 -124.06 111.02 15.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.976 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.006 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -72.65 170.48 14.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.678 179.711 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.498 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.23 -50.0 0.05 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.695 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -146.05 37.59 1.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.958 0.409 . . . . 0.0 110.692 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.817 HG11 HD21 ' B' ' 29' ' ' LEU . 93.3 t -152.08 170.4 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.863 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.709 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -142.66 115.01 8.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 0.0 110.919 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.71 HD13 HG23 ' B' ' 58' ' ' VAL . 0.4 OUTLIER -101.75 129.77 52.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.253 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.905 HD22 ' CB ' ' B' ' 64' ' ' SER . 0.3 OUTLIER -118.2 87.14 2.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.532 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.764 HD12 ' CB ' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -89.46 134.62 34.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.855 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -160.27 126.86 4.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.962 ' HG3' ' HA ' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -110.32 142.95 41.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.024 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.812 ' HB2' ' HE2' ' B' ' 55' ' ' HIS . 0.2 OUTLIER -86.21 19.35 2.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.211 0.529 . . . . 0.0 110.729 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.421 -1.21 . . . . 0.0 112.506 179.901 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.672 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.104 0 CA-C-O 120.699 0.285 . . . . 0.0 110.807 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.998 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 160.59 168.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.915 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.672 HG12 ' O ' ' A' ' 7' ' ' VAL . 98.8 t -131.13 60.75 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.929 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.859 HD11 HD11 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -36.04 132.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.694 -179.897 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -114.33 -16.29 12.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.984 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.595 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 1.7 m-20 -173.99 160.06 3.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.665 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.595 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 171.07 113.86 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.778 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.732 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 41.6 m-20 -98.52 27.62 4.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.024 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.896 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -107.59 168.02 9.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.562 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.896 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -53.69 146.83 12.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.882 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.721 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -56.53 -62.01 2.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.764 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' ' 16' ' ' GLU . 2.6 mp0 -53.96 -24.99 18.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.857 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.586 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 60.2 mmm -77.67 -45.86 23.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.99 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.854 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -61.77 -33.16 73.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.72 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -75.53 -40.37 57.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.149 0.499 . . . . 0.0 109.7 179.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.766 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 1.4 m-20 -69.73 -30.81 68.5 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.548 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -64.45 -50.31 68.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.824 179.198 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.775 HG22 ' CD2' ' A' ' 76' ' ' PHE . 70.3 t -55.43 -47.4 78.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.009 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -53.73 -39.3 65.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.161 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.53 ' HG ' ' HD1' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -65.43 -41.32 93.64 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.045 179.24 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.668 ' HB2' HG21 ' A' ' 83' ' ' ILE . . . -66.69 -28.94 68.85 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.685 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.6 OUTLIER -72.73 -42.25 64.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.641 178.655 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.497 HE21 ' HB3' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -51.62 -46.06 63.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.528 179.365 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.926 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -81.07 -20.55 41.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.683 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.739 HD11 ' HG ' ' A' ' 78' ' ' LEU . 6.7 mt -77.46 -29.93 52.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.249 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 -34.77 14.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.204 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.563 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -82.9 -14.14 54.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.449 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.633 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.35 169.7 22.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.761 179.535 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.725 ' C ' HD13 ' A' ' 34' ' ' ILE . 1.3 t30 -137.93 29.18 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.913 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 1.2 mm -116.63 108.22 24.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.065 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.682 ' HA ' HD12 ' A' ' 38' ' ' ILE . 23.6 mp0 -29.1 -74.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.503 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.4 OUTLIER -42.61 -61.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.753 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.913 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.3 OUTLIER -44.43 -62.85 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.926 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 3.3 mt -45.18 -48.46 3.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.868 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -57.94 -43.85 86.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.071 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.799 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.94 -64.77 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.067 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.692 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -49.15 -56.8 8.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.931 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.815 HD11 HG22 ' A' ' 38' ' ' ILE . 47.3 mt -42.52 -62.52 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.952 ' HE2' ' H ' ' A' ' 54' ' ' TRP . 13.0 tptp -51.49 -60.44 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.01 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -36.93 -56.02 0.89 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.069 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 48' ' ' LYS . 18.3 tt0 -60.97 -69.06 0.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.3 OUTLIER -37.35 -38.16 0.22 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.315 -179.84 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.708 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.1 OUTLIER -71.58 -38.52 70.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.471 -179.467 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.478 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -101.64 9.96 40.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.723 0.297 . . . . 0.0 111.373 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.42 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -125.54 -7.48 6.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.323 -179.899 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.766 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 39.8 m-85 -133.04 -63.3 0.77 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.994 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.1 OUTLIER 161.79 108.86 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.313 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.708 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 73.0 Cg_exo -49.53 153.56 5.11 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.446 2.097 . . . . 0.0 112.434 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 1.027 HG21 HG21 ' B' ' 67' ' ' THR . 44.5 m -117.06 137.11 52.48 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 122.998 0.519 . . . . 0.0 110.699 0.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.952 ' H ' ' HE2' ' A' ' 43' ' ' LYS . 64.8 m95 -98.76 160.81 14.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.39 0.614 . . . . 0.0 111.748 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.864 ' HD2' ' HA ' ' A' ' 87' ' ' LYS . 2.4 m-70 -141.26 100.42 3.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.016 179.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.943 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.8 OUTLIER -113.27 144.35 42.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.355 0.597 . . . . 0.0 112.573 -178.051 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.976 HG12 HD23 ' A' ' 84' ' ' LEU . 18.0 mm -132.87 111.82 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.334 179.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.868 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.8 p -111.01 126.83 68.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.933 0.397 . . . . 0.0 111.58 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.609 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -147.48 -151.34 5.4 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.677 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.5 26.02 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.773 0.287 . . . . 0.0 111.586 -179.75 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.677 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 164.5 26.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 0.0 111.143 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.861 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 14.8 p90 -102.67 -179.54 4.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.842 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.786 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -132.6 108.57 0.78 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.785 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.861 ' HB3' ' HE1' ' A' ' 62' ' ' PHE . 7.2 p -93.94 124.75 38.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.982 0.42 . . . . 0.0 111.53 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.814 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 33.1 t80 -135.8 82.14 1.93 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.376 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.851 HG13 HD11 ' B' ' 57' ' ' ILE . 14.6 m -125.89 152.27 32.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.4 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 1.032 HG21 HG21 ' B' ' 53' ' ' THR . 0.6 OUTLIER -79.49 115.71 19.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.617 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.821 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -74.87 148.41 40.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.96 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.752 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 3.5 mm-40 -113.94 -131.52 0.32 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.481 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.583 ' OG1' ' N ' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -27.57 -99.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.679 -179.56 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.751 ' O ' ' HB2' ' A' ' 13' ' ' MET . 0.1 OUTLIER -70.29 22.49 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.962 0.41 . . . . 0.0 110.697 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.821 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 24.6 m-70 56.97 -85.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.874 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.744 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 164.61 -170.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.895 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.859 HD11 HD11 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -160.34 110.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.597 179.771 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.597 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 34.6 t80 -103.71 137.26 42.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.605 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.84 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.5 OUTLIER -151.17 169.73 21.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.81 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.777 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 10.2 t80 -126.59 98.11 5.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.002 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.998 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.3 OUTLIER -59.46 177.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.73 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.546 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -56.63 81.4 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.464 179.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.777 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.0 OUTLIER 84.1 22.87 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.177 0.513 . . . . 0.0 110.016 -178.9 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.907 ' HB ' ' HB2' ' A' ' 78' ' ' LEU . 72.5 t -142.63 173.02 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.75 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.756 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -146.25 146.26 30.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.695 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.817 HD13 HG23 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -135.79 133.1 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.008 0.432 . . . . 0.0 111.531 -179.517 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.976 HD23 HG12 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -118.34 93.96 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.045 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.766 HD11 HG21 ' A' ' 42' ' ' ILE . 0.7 OUTLIER -98.81 124.67 43.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.636 -179.155 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.782 ' CE1' HG21 ' A' ' 66' ' ' VAL . 18.7 p90 -162.72 129.95 3.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.049 179.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.864 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 1.0 OUTLIER -104.87 151.17 24.16 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.926 0.393 . . . . 0.0 111.159 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.752 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 CA-C-O 121.329 0.585 . . . . 0.0 110.741 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . . . . . . . . . 27.0 mmt-85 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.724 0.297 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.505 ' O ' HG11 ' B' ' 22' ' ' VAL . 0.0 OUTLIER 72.51 174.36 0.29 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.828 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.03 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 66.06 164.64 0.18 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.422 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.601 ' O ' ' HG2' ' B' ' 9' ' ' LYS . 24.3 t -130.43 71.9 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.739 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.814 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -32.08 152.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.77 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.824 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 1.8 mmpt? -147.16 -6.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.511 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.602 ' HB3' ' HZ ' ' B' ' 73' ' ' PHE . 0.3 OUTLIER -176.65 90.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.516 179.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.878 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -127.98 97.74 4.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.423 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.83 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 1.4 m-20 -95.07 25.96 3.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.067 0.46 . . . . 0.0 110.393 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.726 ' HG3' ' H ' ' B' ' 14' ' ' SER . 12.8 ttp -110.4 168.78 9.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.544 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.726 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.6 OUTLIER -49.24 125.83 11.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.766 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.488 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 45.9 mt-10 -39.29 -56.37 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.785 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -56.41 -30.6 62.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.532 ' CB ' ' HG2' ' B' ' 13' ' ' MET . 30.8 mmm -72.82 -44.09 61.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.071 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 1.032 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -62.94 -32.39 73.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -75.03 -42.77 56.56 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.196 0.522 . . . . 0.0 109.682 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.55 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 25.1 m-20 -68.1 -28.87 67.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.511 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.786 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -66.67 -48.62 68.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.956 179.094 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.825 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 90.9 t -55.27 -50.15 66.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.136 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.83 -34.99 68.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.948 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.473 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 3.2 m -69.55 -36.12 76.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.754 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.77 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.36 -28.81 64.32 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 3.7 m -74.31 -40.39 62.27 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.75 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.769 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 1.8 mm-40 -56.6 -44.43 81.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.681 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.978 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -68.21 -36.7 79.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.067 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.77 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.8 mt -65.46 -41.08 93.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -25.88 54.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.736 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.769 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 23.6 mmtm -88.12 -22.65 23.99 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.687 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.53 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -159.66 163.71 34.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.699 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.469 ' OD1' ' N ' ' B' ' 33' ' ' ASN . 0.0 OUTLIER -123.28 29.75 6.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.935 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.746 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.7 mm -113.67 106.41 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.892 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.786 ' HB3' ' HA3' ' A' ' 63' ' ' GLY . 1.2 mp0 -29.89 -70.34 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.898 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.438 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -43.33 -52.33 5.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.633 179.559 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.746 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 7.0 t0 -55.49 -60.49 3.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.369 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.978 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 3.8 mt -42.74 -55.1 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.713 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.98 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.46 -53.73 21.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.814 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -51.37 -69.29 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.263 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.755 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -33.78 -42.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.359 179.134 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.747 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 53.6 mt -69.04 -66.35 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.324 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.596 ' HD3' ' CD1' ' A' ' 65' ' ' TYR . 7.3 tttp -40.49 -43.55 1.86 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.075 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -69.02 -49.4 58.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.277 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.561 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 41.6 tt0 -63.22 -25.95 68.57 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.786 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -79.33 -37.81 36.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.874 0.369 . . . . 0.0 110.771 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.933 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.62 -32.82 73.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.609 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.4 mmmt -90.56 -33.78 15.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.221 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 7.7 tttp -81.03 -12.66 59.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.387 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.751 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 17.4 m-85 -142.75 -66.59 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.658 0.266 . . . . 0.0 111.596 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.751 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.2 t30 160.74 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.398 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.933 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 21.0 Cg_endo -60.43 169.42 5.29 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.472 2.115 . . . . 0.0 112.377 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 1.032 HG21 HG21 ' A' ' 67' ' ' THR . 1.8 t -110.89 120.73 43.37 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 122.926 0.49 . . . . 0.0 110.733 0.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.856 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 31.2 m95 -90.55 141.23 28.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.46 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.815 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 4.1 m170 -107.1 105.39 15.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.338 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.69 ' O ' HD13 ' B' ' 57' ' ' ILE . 9.8 t -111.74 133.08 54.21 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.997 ' CG1' HD23 ' B' ' 84' ' ' LEU . 23.8 mm -127.08 99.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.56 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 0.98 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.6 p -104.98 118.78 52.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.048 0.451 . . . . 0.0 111.847 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.905 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -134.87 -116.03 1.59 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.198 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -174.15 -31.86 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.786 0.327 . . . . 0.0 111.022 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.432 ' HA ' HD22 ' B' ' 61' ' ' ASN . 0.0 OUTLIER -154.67 43.11 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.925 -179.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.913 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 27.9 p90 -99.68 -167.15 1.42 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 0.0 111.07 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.681 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -140.5 98.11 0.23 Allowed Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.709 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.941 ' CB ' HD22 ' B' ' 84' ' ' LEU . 3.8 p -89.22 128.42 35.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.996 0.427 . . . . 0.0 111.668 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.799 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 52.5 t80 -139.48 86.54 2.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.343 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.922 HG13 HD11 ' A' ' 57' ' ' ILE . 12.2 m -136.92 141.42 40.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.179 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 1.027 HG21 HG21 ' A' ' 53' ' ' THR . 1.3 t -70.37 139.54 51.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.043 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.783 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -98.76 162.15 13.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.532 ' HB2' ' H ' ' B' ' 70' ' ' THR . 0.1 OUTLIER -131.75 -101.26 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.33 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.557 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -46.04 -108.08 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.389 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.687 ' O ' ' HB2' ' B' ' 13' ' ' MET . 2.1 mmtp -70.5 29.3 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.88 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.83 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 37.9 m-70 57.22 -83.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.778 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 163.05 -153.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.73 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 1.032 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.6 OUTLIER -172.54 135.6 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.549 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.824 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 5.2 t80 -124.05 139.62 53.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.999 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.825 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 0.8 OUTLIER -165.73 147.11 7.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.977 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.723 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 64.5 t80 -112.7 109.5 19.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.03 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.4 mm? -69.1 169.55 11.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.061 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.543 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -19.75 -67.86 0.01 OUTLIER Glycine 0 C--N 1.335 0.479 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.86 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.422 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 0.0 OUTLIER -130.86 39.0 3.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.049 0.452 . . . . 0.0 110.064 179.223 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.905 HG13 ' O ' ' B' ' 59' ' ' GLY . 93.0 t -152.69 170.18 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.114 -179.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.99 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -131.51 162.15 30.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.367 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.99 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -145.61 133.98 16.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.977 0.417 . . . . 0.0 111.489 -179.615 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.997 HD23 ' CG1' ' B' ' 57' ' ' ILE . 4.9 tp -124.15 88.19 2.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.444 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.757 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -95.02 122.33 37.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.246 -179.44 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.838 ' CE2' HG21 ' B' ' 66' ' ' VAL . 0.5 OUTLIER -153.52 120.1 5.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.022 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.856 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -86.22 132.06 34.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.893 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.815 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 2.4 m -94.73 19.53 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.228 0.537 . . . . 0.0 110.956 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . 0.471 ' OXT' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.368 -1.24 . . . . 0.0 112.525 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.758 0.313 . . . . 0.0 111.295 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.095 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -131.07 -171.05 2.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.128 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.451 ' N ' ' O ' ' A' ' 77' ' ' TYR . 25.9 t -145.79 78.69 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.262 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.802 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 1.4 mp -40.03 142.41 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.479 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 3.7 mmpt? -129.83 -12.78 4.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.03 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.57 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 14.4 t30 -154.89 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 1.086 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 76.68 -176.59 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.619 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.777 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 1.0 OUTLIER 162.23 22.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.807 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.923 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 11.0 ttp -114.58 164.59 13.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.687 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 1.044 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 68.5 m -45.3 135.27 6.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.522 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.473 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.2 mm-40 -41.67 -75.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.071 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -44.68 -22.15 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 1.044 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.54 -39.73 31.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.816 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -67.73 -30.1 69.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.589 179.811 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -45.77 19.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -68.18 -29.49 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.484 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.816 ' OG ' HG21 ' A' ' 74' ' ' ILE . 0.2 OUTLIER -66.66 -50.83 61.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.086 179.182 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.819 ' HA ' ' CZ ' ' A' ' 76' ' ' PHE . 58.0 t -57.13 -40.36 72.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.343 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -63.85 -34.66 78.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.203 179.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -71.78 -34.06 69.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.764 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.696 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -73.42 -34.15 65.33 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.832 ' HA ' HD12 ' A' ' 29' ' ' LEU . 42.0 m -71.71 -40.19 69.64 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.619 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.823 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -56.17 -43.33 78.28 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.249 178.94 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.943 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -74.93 -22.92 58.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.807 178.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.832 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.9 mt -73.46 -38.38 65.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.945 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.01 -25.21 26.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.768 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -83.92 -35.27 24.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.725 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.654 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -149.92 150.58 32.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.664 ' HA ' HD11 ' A' ' 38' ' ' ILE . 2.2 t-20 -127.51 48.57 2.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.772 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.887 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 40.4 mm -115.45 43.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.701 ' HG2' ' HA ' ' B' ' 62' ' ' PHE . 3.1 mp0 34.56 -87.56 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.596 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.613 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -43.19 -53.75 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.865 0.364 . . . . 0.0 110.456 179.53 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.887 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.4 t70 -45.86 -61.94 1.52 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.588 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.943 HG23 ' HB3' ' A' ' 28' ' ' ALA . 3.7 mt -45.5 -58.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.933 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -49.29 -54.61 16.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.718 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -42.53 -55.24 3.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.111 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.539 ' CE1' ' CD1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.817 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.703 ' CG2' HD11 ' A' ' 85' ' ' LEU . 64.2 mt -47.68 -69.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.218 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.852 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -49.97 -67.08 0.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.987 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.788 ' HD2' ' N ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -33.0 -59.69 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.911 -179.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.788 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 5.2 tp10 -54.66 -54.84 36.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.704 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -52.66 -31.65 38.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.942 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.73 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -72.94 -32.15 65.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.872 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mmmm -106.27 4.61 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.372 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.484 ' O ' ' CG ' ' A' ' 50' ' ' TYR . 6.2 tttp -123.98 13.75 9.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.789 0.328 . . . . 0.0 111.101 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.675 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 57.2 m-85 -159.94 -66.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.12 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.488 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 0.6 OUTLIER 162.09 115.57 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.726 -179.773 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.73 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 36.4 Cg_endo -64.98 170.49 10.25 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.433 2.089 . . . . 0.0 112.398 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.68 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.5 t -102.65 128.12 49.47 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 122.86 0.464 . . . . 0.0 110.358 -0.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.836 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 63.6 m95 -94.27 151.44 19.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.407 0.622 . . . . 0.0 111.929 -179.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.826 ' HB2' ' CE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -136.67 94.19 2.96 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.954 179.257 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.995 ' HB2' HD12 ' A' ' 85' ' ' LEU . 8.8 p -115.97 154.9 29.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.349 0.595 . . . . 0.0 112.422 -178.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.994 HD12 ' HA ' ' B' ' 64' ' ' SER . 16.3 mm -126.96 174.71 10.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.001 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.933 HG12 ' HB2' ' A' ' 39' ' ' ALA . 8.1 p -170.88 110.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.961 0.41 . . . . 0.0 111.76 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.686 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.39 -135.83 2.15 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.765 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.447 ' H ' ' H ' ' A' ' 61' ' ' ASN . 4.5 ptt180 -173.69 -9.85 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.587 ' H ' HD22 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -148.72 44.83 1.02 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.087 -179.896 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.849 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -120.19 165.73 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.93 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.854 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -112.77 86.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.792 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.952 ' HA ' HG23 ' B' ' 57' ' ' ILE . 2.9 p -81.91 118.56 23.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.045 0.45 . . . . 0.0 111.58 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.984 ' H ' HD13 ' B' ' 57' ' ' ILE . 7.4 t80 -132.37 76.68 1.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.006 HG13 HD11 ' B' ' 57' ' ' ILE . 5.5 m -127.55 140.44 49.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.824 HG21 HG21 ' B' ' 53' ' ' THR . 3.3 t -95.69 120.52 36.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.435 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -60.95 -164.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.876 -179.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.521 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 1.0 OUTLIER -127.11 -46.84 1.5 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.346 -179.752 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.504 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 28.3 m -157.92 -42.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.481 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.777 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 7.7 mtpt -164.7 -159.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.758 0.313 . . . . 0.0 110.882 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 1.044 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 0.0 OUTLIER 56.17 18.82 3.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.011 0.434 . . . . 0.0 110.436 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.829 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 7.0 t80 -116.15 101.61 8.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.498 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 1.086 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -121.4 118.25 55.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.316 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -115.21 94.6 4.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.763 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.819 ' CZ ' ' HA ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -114.7 -178.88 3.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.164 -179.778 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.688 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 16.1 t80 -140.31 102.69 4.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.095 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -59.64 173.05 0.6 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.273 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.96 -44.86 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.936 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.418 ' N ' ' O ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -148.21 26.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.22 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.754 HG11 HD21 ' A' ' 29' ' ' LEU . 72.2 t -139.65 168.3 18.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.989 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.723 ' O ' ' HA ' ' A' ' 58' ' ' VAL . . . -136.63 125.88 24.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.594 HG21 ' CB ' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -113.23 119.99 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.993 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.981 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 21.4 tp -100.78 80.45 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.18 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.995 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -86.32 137.78 32.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.072 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.829 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -174.23 127.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.563 179.635 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 1.044 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -90.14 -169.75 2.53 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.925 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.521 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-O 121.308 0.575 . . . . 0.0 110.81 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.525 ' NH1' HE22 ' B' ' 19' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.457 -0.093 0 CA-C-O 120.868 0.366 . . . . 0.0 110.684 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.632 ' HG2' ' H ' ' B' ' 6' ' ' ALA . 22.8 tttt 76.62 -152.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.724 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.075 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 52.74 175.85 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.183 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.748 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 59.0 t -147.83 71.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.727 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.793 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -34.8 140.32 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.521 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.748 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 3.2 mmtp -115.27 -25.58 7.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.213 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -140.83 -87.97 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.165 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 1.066 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 62.64 106.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.095 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -109.28 24.32 13.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.648 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.761 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -107.82 173.31 6.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.761 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.2 OUTLIER -54.61 128.0 30.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.856 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.613 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 1.7 mm-40 -39.85 -64.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -50.36 -27.45 6.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.548 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.647 ' HB2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -75.55 -31.61 60.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.701 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 1.054 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -71.29 -36.2 71.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.395 179.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.556 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 20.1 mt-30 -74.82 -35.57 62.44 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.88 -34.91 62.29 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.856 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 1.4 t -65.19 -42.49 93.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.756 179.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.964 HG22 ' CD2' ' B' ' 76' ' ' PHE . 91.2 t -60.94 -50.0 82.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.332 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.556 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 20.7 mt-10 -53.75 -38.61 64.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.297 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.598 ' SG ' ' CE1' ' B' ' 46' ' ' PHE . 71.9 m -65.71 -38.46 89.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.011 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.805 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -68.77 -30.2 68.75 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.412 ' H ' ' HG1' ' B' ' 26' ' ' THR . 0.7 OUTLIER -72.43 -40.2 67.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.361 -1.291 . . . . 0.0 109.926 178.787 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.857 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -56.86 -43.77 81.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.892 179.354 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 1.061 ' HB3' HG23 ' B' ' 38' ' ' ILE . . . -73.51 -34.29 65.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.423 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.805 HD12 ' O ' ' B' ' 25' ' ' ALA . 2.3 mt -65.53 -40.82 93.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.876 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.96 -18.52 34.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 1.1 mmmm -83.38 -21.14 33.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.822 ' CB ' HD13 ' B' ' 34' ' ' ILE . 0.1 OUTLIER -153.01 -49.0 0.1 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.792 -179.921 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.611 ' C ' HD12 ' B' ' 34' ' ' ILE . 3.4 t-20 83.37 28.42 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.777 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.822 HD13 ' CB ' ' B' ' 32' ' ' TYR . 1.1 mp -111.2 140.76 29.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.736 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.854 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -53.91 -70.91 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.897 0.379 . . . . 0.0 110.62 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.527 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -54.18 -55.86 23.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.609 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 12.3 t0 -47.4 -60.74 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.723 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 1.061 HG23 ' HB3' ' B' ' 28' ' ' ALA . 26.6 mt -46.88 -60.66 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.982 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.764 ' CB ' ' HB2' ' A' ' 65' ' ' TYR . . . -40.94 -46.1 2.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 0.0 110.562 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.819 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -63.08 -62.93 1.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.406 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.857 ' NE2' ' HB3' ' B' ' 27' ' ' GLN . 0.8 OUTLIER -39.23 -42.3 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.59 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.783 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 7.9 mt -72.47 -70.14 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.256 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.831 ' NZ ' HG23 ' B' ' 53' ' ' THR . 27.9 tttp -36.97 -48.02 0.74 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.642 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 6.5 mttt -62.39 -56.03 22.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.261 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.777 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -57.01 -58.32 8.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.831 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.856 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -40.57 -64.24 0.55 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.958 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.789 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 2.8 p30 -46.4 -42.41 15.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.844 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.777 ' HG3' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -69.93 -36.87 75.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.865 -179.379 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.466 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.35 -9.66 46.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.693 -179.212 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.753 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 92.8 m-85 -127.5 -70.05 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.454 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.753 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 5.7 t-20 161.06 109.45 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.035 -179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.789 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 96.8 Cg_exo -43.53 154.65 0.2 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 122.344 2.029 . . . . 0.0 112.479 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.831 HG23 ' NZ ' ' B' ' 43' ' ' LYS . 6.1 m -119.2 134.62 55.11 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 122.927 0.491 . . . . 0.0 110.652 0.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.789 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 45.0 m95 -100.12 125.71 46.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.055 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.727 ' HB2' ' O ' ' B' ' 86' ' ' PHE . 62.8 m170 -93.77 94.76 8.72 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.726 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.7 OUTLIER -102.52 151.39 22.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -177.37 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 1.06 HG13 HD23 ' B' ' 84' ' ' LEU . 13.7 mm -139.83 155.82 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.386 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 0.816 HG23 HG11 ' B' ' 81' ' ' VAL . 1.5 p -162.11 109.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 111.59 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.841 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -136.23 -123.28 2.26 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.832 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 60' ' ' ARG . 0.8 OUTLIER -166.09 -23.88 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.57 0.224 . . . . 0.0 111.523 179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.607 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 1.5 m-20 -157.61 46.25 0.37 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.824 0.345 . . . . 0.0 111.282 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.849 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.2 p90 -102.88 175.08 5.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.938 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.79 87.43 0.41 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.375 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.994 ' HA ' HD12 ' A' ' 57' ' ' ILE . 10.9 p -85.21 121.64 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.958 0.409 . . . . 0.0 111.105 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.852 ' HE2' ' HD2' ' A' ' 43' ' ' LYS . 11.6 t80 -134.18 61.33 1.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.629 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.942 HG13 HD11 ' A' ' 57' ' ' ILE . 17.5 m -96.7 164.65 2.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.16 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.671 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 93.5 m -101.7 98.93 9.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.861 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -43.36 169.85 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.717 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.8 OUTLIER -142.13 -119.78 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.99 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.568 ' C ' ' H ' ' B' ' 72' ' ' HIS . 41.5 p -39.4 -98.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.014 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' B' ' 13' ' ' MET . 3.4 mmmm -68.74 18.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.77 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.861 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 20.1 m170 65.78 -88.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.765 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 2.4 p90 165.74 -176.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.0 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 1.066 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -156.67 114.63 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.545 179.305 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.811 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 1.3 t80 -100.4 137.71 38.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.918 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.964 ' CD2' HG22 ' B' ' 22' ' ' VAL . 1.0 OUTLIER -162.62 156.83 21.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.824 0.345 . . . . 0.0 111.376 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 2.1 t80 -116.89 112.61 21.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.292 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.075 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.1 mm? -69.92 170.31 11.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.639 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.5 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -28.5 -36.29 0.01 OUTLIER Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.497 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.615 ' O ' HG23 ' B' ' 81' ' ' VAL . 0.4 OUTLIER -158.62 44.35 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.921 0.391 . . . . 0.0 110.694 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.841 HG13 ' O ' ' B' ' 59' ' ' GLY . 37.7 t -160.02 169.36 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.036 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.606 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -135.88 111.13 9.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.344 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.781 ' HB ' ' CZ ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -98.64 133.61 40.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.157 0.503 . . . . 0.0 112.012 -179.191 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 1.06 HD23 HG13 ' B' ' 57' ' ' ILE . 0.4 OUTLIER -118.85 94.39 4.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.768 179.423 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.765 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 0.5 OUTLIER -98.24 135.7 39.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -179.031 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.727 ' O ' ' HB2' ' B' ' 55' ' ' HIS . 9.3 p90 -174.43 121.03 0.26 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.84 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.789 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -90.49 161.51 15.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 110.923 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.717 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -117.76 21.23 13.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.338 0.59 . . . . 0.0 110.486 179.774 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.151 0 CA-C-O 118.325 -1.264 . . . . 0.0 112.504 -179.806 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.8 0.333 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.975 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.41 153.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.75 HG12 ' HE2' ' A' ' 9' ' ' LYS . 92.4 t -118.66 71.12 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.834 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.877 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -35.63 137.02 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.75 ' HE2' HG12 ' A' ' 7' ' ' VAL . 12.0 mmtt -125.82 -11.26 6.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.647 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.56 ' O ' ' HE1' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -168.52 87.12 0.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.799 -179.833 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.668 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -121.91 109.42 14.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.911 0.386 . . . . 0.0 111.685 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.64 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 2.7 m-20 -112.23 30.66 6.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.123 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.781 ' H ' HE22 ' A' ' 18' ' ' GLN . 11.3 ttp -117.89 171.05 8.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.761 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.729 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 m -53.55 134.62 40.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.028 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.655 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 tm-20 -45.99 -68.27 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.93 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.718 ' HA ' ' NE2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -44.49 -27.33 0.44 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.831 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.645 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.79 -50.03 16.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.541 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.973 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -58.72 -26.83 64.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.481 179.738 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.718 ' NE2' ' HA ' ' A' ' 16' ' ' GLU . 4.2 pt20 -77.85 -45.29 24.74 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.441 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 36.5 m-20 -67.4 -26.53 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.563 178.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.946 ' OG ' HD22 ' A' ' 85' ' ' LEU . 28.8 t -68.0 -52.57 34.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.612 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.837 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 47.5 t -54.5 -47.7 70.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.48 -35.81 72.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.95 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.923 ' SG ' HG23 ' A' ' 42' ' ' ILE . 10.2 t -67.29 -35.4 79.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.986 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.748 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -72.86 -33.99 66.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.603 ' HA ' HD12 ' A' ' 29' ' ' LEU . 2.4 m -69.62 -37.32 76.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.523 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 2.7 mt-30 -61.78 -41.73 98.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.855 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.77 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -79.5 -17.4 54.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.138 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.658 HD12 ' C ' ' A' ' 25' ' ' ALA . 5.5 mt -80.97 -37.01 30.05 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.971 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.21 -26.96 23.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.249 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.523 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -85.07 -23.6 28.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.951 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.601 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -144.29 -161.2 1.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.644 ' C ' HD13 ' A' ' 34' ' ' ILE . 5.5 t-20 -166.32 28.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.613 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.042 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.4 mm -118.39 103.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.665 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.669 ' HA ' HD12 ' A' ' 38' ' ' ILE . 1.0 OUTLIER -26.33 -77.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.012 0.434 . . . . 0.0 110.821 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.529 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -40.36 -42.15 1.51 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.905 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 1.042 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -64.89 -58.75 5.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.913 ' HB ' HG11 ' A' ' 58' ' ' VAL . 3.8 mt -46.82 -48.42 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.997 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.56 -38.86 82.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.867 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.801 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -59.85 -67.71 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.015 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.674 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -50.39 -49.96 52.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.824 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.923 HG23 ' SG ' ' A' ' 24' ' ' CYS . 98.2 mt -49.99 -67.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.167 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.807 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 4.5 tmtt? -51.25 -40.75 59.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.582 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 1.1 tppt? -54.39 -57.37 11.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.015 0.436 . . . . 0.0 110.736 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 49' ' ' LYS . 5.3 mt-10 -54.0 -54.57 37.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.644 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.789 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.7 m-85 -52.23 -46.75 65.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.867 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.807 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.81 -12.54 61.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.292 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.423 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -123.66 13.21 9.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.739 0.304 . . . . 0.0 111.259 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' A' ' 45' ' ' GLU . 6.0 ttmm -129.96 -31.61 1.92 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.189 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.682 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 60.0 m-85 -109.82 -57.23 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.074 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.78 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 0.0 OUTLIER 160.83 114.22 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.433 -179.789 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.714 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 16.5 Cg_endo -57.16 165.92 4.82 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.355 2.037 . . . . 0.0 112.455 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.717 HG21 HG21 ' B' ' 67' ' ' THR . 1.2 m -108.66 124.89 51.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 122.974 0.509 . . . . 0.0 110.361 -0.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.75 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.5 m95 -96.89 160.84 14.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.607 . . . . 0.0 111.996 -179.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.823 ' HD2' ' HA ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -152.43 111.98 3.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.079 179.352 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.926 ' HB2' HD12 ' A' ' 85' ' ' LEU . 13.7 p -120.3 151.61 38.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.033 HD11 HG13 ' B' ' 66' ' ' VAL . 20.8 mm -126.03 118.36 51.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.444 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.997 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.4 p -113.04 124.03 69.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.6 ' O ' ' HB3' ' A' ' 82' ' ' ALA . . . -157.9 173.84 35.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.275 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.5 OUTLIER -137.7 40.05 2.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.678 0.275 . . . . 0.0 111.295 -179.632 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER 167.89 28.8 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.919 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.878 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 15.7 p90 -117.0 -172.32 2.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.163 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.811 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.63 102.49 0.27 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.737 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.967 ' CB ' HD12 ' B' ' 57' ' ' ILE . 63.6 p -84.87 138.22 32.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.063 0.459 . . . . 0.0 111.731 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.823 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 54.8 t80 -153.32 89.63 1.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.034 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.743 HG12 ' N ' ' B' ' 56' ' ' CYS . 6.2 m -135.18 -161.44 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.203 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.869 ' HB ' HG21 ' B' ' 53' ' ' THR . 0.7 OUTLIER -99.88 -161.16 0.85 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.794 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.713 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 38.4 p-80 -168.42 122.53 0.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.804 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.545 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -130.83 157.89 41.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.511 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 74.94 -85.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.047 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.538 ' O ' ' HB2' ' A' ' 13' ' ' MET . 28.7 mttt -109.96 14.44 23.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.713 ' O ' ' HB2' ' A' ' 68' ' ' HIS . 6.7 m170 71.64 -86.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.752 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.694 ' HB3' ' HB2' ' A' ' 86' ' ' PHE . 1.8 p90 162.3 -167.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.436 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.973 HG13 ' HB3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -165.39 110.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.994 0.426 . . . . 0.0 111.673 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.749 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -100.39 138.06 37.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.079 179.198 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.972 ' CE1' HD13 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -159.22 132.97 7.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.979 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' A' ' 81' ' ' VAL . 18.7 t80 -98.95 102.37 14.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.798 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.975 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.2 mm? -55.82 170.02 0.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.763 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.89 -33.25 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.661 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.572 ' N ' ' O ' ' A' ' 78' ' ' LEU . 0.4 OUTLIER -160.08 39.84 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 111.094 -179.812 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.616 HG12 ' N ' ' A' ' 82' ' ' ALA . 81.3 t -156.95 165.31 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.746 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.662 ' C ' HD13 ' A' ' 83' ' ' ILE . . . -125.82 140.97 52.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.553 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.662 HD13 ' C ' ' A' ' 82' ' ' ALA . 0.0 OUTLIER -134.18 130.73 54.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.979 0.418 . . . . 0.0 111.446 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.814 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -120.35 97.7 5.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.851 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.946 HD22 ' OG ' ' A' ' 21' ' ' SER . 1.4 mp -99.65 124.34 44.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.61 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.694 ' HB2' ' HB3' ' A' ' 73' ' ' PHE . 3.0 p90 -166.04 140.79 4.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.29 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.823 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 15.8 mtpt -90.24 -147.18 0.19 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.593 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.674 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-O 121.386 0.612 . . . . 0.0 110.473 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.59 ' O ' ' HB3' ' B' ' 5' ' ' LYS . 1.9 tpp85 . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.81 0.338 . . . . 0.0 111.056 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.59 ' HB3' ' O ' ' B' ' 4' ' ' ARG . 0.7 OUTLIER 79.32 31.04 0.29 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.667 -179.757 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.46 -165.94 1.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.454 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.576 ' N ' ' O ' ' B' ' 77' ' ' TYR . 87.7 t -154.08 75.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.195 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.789 HD12 ' HB3' ' B' ' 76' ' ' PHE . 1.3 mp -34.69 140.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.266 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.475 ' HE3' ' HB3' ' B' ' 77' ' ' TYR . 7.0 mmtp -119.55 -11.32 9.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.769 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.636 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 1.2 t-20 -168.7 -94.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.392 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.896 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 80.41 -179.67 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.598 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.4 m-20 177.15 35.26 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.694 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.808 ' H ' ' NE2' ' B' ' 18' ' ' GLN . 19.6 ttp -130.87 167.66 18.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.838 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.591 ' O ' ' HB2' ' B' ' 17' ' ' MET . 0.0 OUTLIER -48.63 131.3 17.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.474 ' CA ' ' HG2' ' B' ' 18' ' ' GLN . 1.7 mp0 -40.99 -64.92 0.48 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.671 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 1.1 mm-40 -46.32 -35.96 5.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.305 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.779 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 43.9 mmm -68.34 -33.72 74.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.049 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 1.015 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.7 OUTLIER -73.54 -33.74 64.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.137 179.232 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.739 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 13.1 pt20 -78.0 -36.36 48.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.582 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.664 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER -76.53 -31.64 57.76 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.323 178.623 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -67.88 -49.13 63.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.861 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.949 HG23 ' O ' ' B' ' 18' ' ' GLN . 48.6 t -59.47 -42.94 89.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.228 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.739 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 2.2 mt-10 -60.71 -34.33 74.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.079 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 47.1 m -68.85 -38.5 79.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.118 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.799 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -68.98 -28.23 66.43 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.565 ' HA ' HD12 ' B' ' 29' ' ' LEU . 4.2 m -72.05 -37.74 69.63 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.64 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.743 ' O ' ' HD3' ' B' ' 31' ' ' LYS . 44.2 mt-30 -59.14 -45.71 90.24 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.454 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.93 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -75.81 -20.37 58.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.486 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.839 ' CD2' HG21 ' B' ' 81' ' ' VAL . 4.8 mt -76.42 -45.1 33.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.054 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.29 -23.74 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.992 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.743 ' HD3' ' O ' ' B' ' 27' ' ' GLN . 1.3 mttp -84.93 -33.52 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.731 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.632 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -141.03 -175.94 4.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.63 179.857 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -145.97 34.82 1.01 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.892 0.377 . . . . 0.0 110.842 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 1.014 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.5 mm -120.23 103.82 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.084 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.811 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -29.57 -64.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 110.698 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.5 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 11.9 mmmt -50.86 -54.75 21.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.076 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 1.014 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.4 m-20 -54.69 -61.62 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.567 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.93 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 9.9 mt -41.15 -45.64 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.757 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 1.037 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -64.83 -45.59 85.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.721 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.823 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -54.35 -57.09 12.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.949 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.766 ' CE1' ' HB3' ' B' ' 37' ' ' ASP . 0.1 OUTLIER -54.55 -40.47 68.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.97 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.73 HG13 ' O ' ' B' ' 38' ' ' ILE . 49.1 mt -64.5 -68.89 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.67 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -40.56 -43.04 1.8 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.79 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.615 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 3.9 mtpp -62.56 -54.31 41.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 10.4 mt-10 -64.69 -25.1 67.8 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.075 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -76.96 -46.41 24.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.921 0.391 . . . . 0.0 110.882 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.787 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.3 p30 -66.76 -24.68 66.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.477 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.447 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -89.94 -42.34 11.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.057 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -80.27 -14.56 58.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.36 -179.584 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.664 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 43.5 m-85 -131.11 -71.16 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.665 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 0.5 OUTLIER 157.39 118.9 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.787 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 26.6 Cg_endo -61.52 170.14 5.87 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.512 2.141 . . . . 0.0 112.347 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.869 HG21 ' HB ' ' A' ' 67' ' ' THR . 1.9 m -101.91 136.83 41.07 Favored 'General case' 0 C--N 1.343 0.287 0 C-N-CA 123.044 0.538 . . . . 0.0 110.612 0.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.783 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 56.4 m95 -107.92 105.45 15.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.505 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.792 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 5.9 m170 -78.25 93.83 4.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.987 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.3 OUTLIER -108.5 140.62 41.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.357 0.599 . . . . 0.0 112.589 -178.017 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.987 HD13 ' O ' ' B' ' 56' ' ' CYS . 19.1 mm -135.56 103.45 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.913 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.037 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -103.52 125.41 58.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.678 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.745 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.2 -110.62 0.73 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.959 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.685 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 6.9 ptt180 168.74 3.57 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 178.8 29.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.683 0.277 . . . . 0.0 111.461 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.875 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 2.9 p90 -92.96 -167.34 1.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.055 0.455 . . . . 0.0 110.832 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -139.94 86.11 0.21 Allowed Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.833 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.895 ' CA ' HD12 ' A' ' 57' ' ' ILE . 5.8 p -82.33 122.51 28.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.065 0.46 . . . . 0.0 111.32 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.801 ' CD1' ' HA ' ' A' ' 40' ' ' ALA . 46.6 t80 -133.44 83.53 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.426 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 1.033 HG13 HD11 ' A' ' 57' ' ' ILE . 7.5 m -118.85 150.34 21.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.717 HG21 HG21 ' A' ' 53' ' ' THR . 18.4 m -73.18 77.87 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.603 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.465 ' HB2' ' CB ' ' B' ' 73' ' ' PHE . 29.4 p-80 -59.59 169.01 1.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.821 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 178.11 173.54 0.61 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.489 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 1.6 m 75.81 -89.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.789 ' HE2' ' CE1' ' B' ' 72' ' ' HIS . 0.5 OUTLIER 166.53 43.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.789 ' CE1' ' HE2' ' B' ' 71' ' ' LYS . 84.9 m-70 -138.85 31.25 2.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.794 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 7.6 t80 -111.8 79.36 1.21 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.566 179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 1.015 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -102.87 123.88 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.173 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.71 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -111.91 137.02 50.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.344 179.645 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.805 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 8.0 p90 -161.18 168.33 24.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.982 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.652 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 47.1 t80 -133.92 115.49 14.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.96 170.1 11.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.619 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.502 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.09 -48.07 0.05 OUTLIER Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.733 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.453 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -146.45 38.78 1.05 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.877 0.37 . . . . 0.0 110.747 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.839 HG21 ' CD2' ' B' ' 29' ' ' LEU . 76.5 t -152.25 167.67 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.961 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.738 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -134.32 143.18 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.701 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.799 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.3 OUTLIER -135.5 128.9 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.996 0.427 . . . . 0.0 111.212 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.779 ' O ' ' HA ' ' B' ' 56' ' ' CYS . 0.1 OUTLIER -121.15 96.83 5.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.521 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.967 HD12 ' HB3' ' B' ' 56' ' ' CYS . 1.8 mp -100.09 117.86 35.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.953 ' CE2' HG21 ' B' ' 66' ' ' VAL . 1.0 OUTLIER -150.99 126.59 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.923 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.783 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.6 OUTLIER -103.7 152.76 21.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.82 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.792 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -111.16 17.64 20.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.255 0.55 . . . . 0.0 110.628 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . 0.471 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.093 0 CA-C-O 118.419 -1.212 . . . . 0.0 112.622 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.921 0.391 . . . . 0.0 110.817 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.62 166.6 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.646 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 7' ' ' VAL . 65.2 t -134.52 71.51 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.767 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.865 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -31.86 152.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.947 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.585 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -142.81 -11.63 0.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.501 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.47 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER 179.63 103.88 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.53 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.674 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -140.02 130.03 24.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.561 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.616 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 27.4 m-20 -121.17 24.15 10.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.304 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.673 ' HG3' ' H ' ' A' ' 14' ' ' SER . 17.0 ttp -104.01 170.47 7.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.794 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.703 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 0.3 OUTLIER -46.82 138.86 5.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.9 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.615 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 24.9 mp0 -50.26 -64.78 0.7 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 6.4 tt0 -58.21 -16.72 14.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.974 0.416 . . . . 0.0 110.097 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.703 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -81.75 -39.15 24.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.669 179.61 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.992 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.16 -37.94 84.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.521 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -75.21 -36.29 61.41 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.532 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 2.1 m-20 -69.5 -35.11 75.23 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.549 178.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.802 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 1.2 t -64.22 -45.37 88.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.728 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.659 HG13 ' HB2' ' A' ' 6' ' ' ALA . 69.5 t -55.97 -51.13 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.327 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -56.93 -34.18 67.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.588 ' HB3' HG23 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -68.88 -34.35 75.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.694 179.131 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.822 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -72.33 -38.39 68.65 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.504 ' HA ' HD12 ' A' ' 29' ' ' LEU . 34.2 m -67.3 -38.06 84.4 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.711 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.786 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -58.65 -44.31 90.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.512 178.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.863 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -72.57 -26.69 61.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.698 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.822 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.6 mt -74.19 -35.82 63.99 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.851 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.94 -28.82 49.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.399 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.786 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 25.5 mmtt -85.2 -33.71 22.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.209 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.589 ' CE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.4 140.8 16.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.503 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -104.75 29.95 5.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.742 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 39.7 mm -104.92 110.22 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.063 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.56 ' HA ' HD12 ' A' ' 38' ' ' ILE . 7.3 mp0 -27.5 -85.83 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.025 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.488 ' HG3' HG22 ' A' ' 34' ' ' ILE . 2.0 pttt -39.13 -34.45 0.17 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.904 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.742 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 49.2 t0 -66.37 -50.88 62.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.069 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.95 HG22 HD11 ' A' ' 42' ' ' ILE . 5.7 mt -58.84 -43.68 88.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 1.012 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -60.23 -39.58 87.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.705 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.797 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -65.55 -63.29 1.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.863 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -42.77 -62.54 0.98 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.478 179.531 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.95 HD11 HG22 ' A' ' 38' ' ' ILE . 16.4 mt -45.42 -66.15 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.356 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.658 ' HB3' ' CE2' ' B' ' 65' ' ' TYR . 0.6 OUTLIER -42.25 -66.23 0.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.938 -179.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.537 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 5.0 tptp -36.61 -54.09 0.88 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.672 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -57.88 -68.82 0.21 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.728 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.802 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.3 m-85 -37.63 -53.31 1.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.94 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.691 ' OD1' ' HG3' ' A' ' 52' ' ' PRO . 4.5 t70 -54.97 -37.32 66.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.868 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -104.88 11.96 33.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 179.85 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 2.8 mmmt -131.12 11.58 5.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.279 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.611 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 77.8 m-85 -157.58 -63.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.63 0.253 . . . . 0.0 111.487 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER 164.17 107.87 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.58 -179.644 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.691 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 82.5 Cg_exo -47.27 152.23 2.32 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.37 2.046 . . . . 0.0 112.43 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 1.014 HG21 HG21 ' B' ' 67' ' ' THR . 91.0 m -117.88 133.31 56.05 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 123.08 0.552 . . . . 0.0 110.557 -0.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.837 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.5 m95 -97.44 143.93 27.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.173 0.511 . . . . 0.0 111.784 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.757 ' HB3' ' CB ' ' B' ' 66' ' ' VAL . 0.3 OUTLIER -131.93 112.76 12.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.278 179.08 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.975 ' HB2' HD12 ' A' ' 85' ' ' LEU . 4.4 p -124.84 154.35 41.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.37 0.605 . . . . 0.0 112.596 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.113 HG21 HG21 ' B' ' 57' ' ' ILE . 12.3 mm -131.15 113.22 23.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.234 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.012 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.5 p -105.02 128.99 58.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.019 0.437 . . . . 0.0 111.184 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.736 ' HA3' ' CD1' ' A' ' 62' ' ' PHE . . . -157.99 170.13 34.8 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.995 -0.621 . . . . 0.0 111.783 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.536 ' HB3' ' HA ' ' A' ' 81' ' ' VAL . 0.0 OUTLIER -132.84 34.82 3.6 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.956 0.408 . . . . 0.0 110.887 -179.792 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 1.1 t-20 169.63 27.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.68 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.982 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 20.7 p90 -115.52 -169.83 1.65 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.906 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.35 95.6 0.17 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.916 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.976 ' CB ' HD12 ' B' ' 57' ' ' ILE . 20.0 p -80.99 140.5 35.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.979 0.419 . . . . 0.0 111.539 -179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.825 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 71.8 t80 -149.13 93.23 2.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.283 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.947 HG21 ' CD2' ' A' ' 86' ' ' PHE . 4.1 m -133.1 149.35 31.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.702 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.929 HG21 HG21 ' B' ' 53' ' ' THR . 1.6 t -79.58 147.31 32.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.679 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 1.044 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -100.92 155.03 18.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.22 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.664 ' HG3' ' OG ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -129.65 -82.48 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.045 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.551 ' C ' ' H ' ' A' ' 72' ' ' HIS . 36.2 m -66.0 -107.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.941 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.586 ' HG3' ' HG3' ' A' ' 13' ' ' MET . 0.0 OUTLIER -69.87 31.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.9 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 1.044 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 1.1 m80 56.61 -91.36 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.636 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.78 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 161.59 -174.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.718 179.756 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.992 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -154.92 131.76 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.265 -179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.538 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 2.3 t80 -120.61 133.39 55.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.071 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.865 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -151.66 164.73 36.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.94 0.4 . . . . 0.0 111.113 -179.516 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.601 ' O ' ' HD1' ' A' ' 77' ' ' TYR . 4.0 t80 -122.92 92.53 3.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.964 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.8 mm? -48.12 166.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.692 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -24.47 -54.93 0.05 OUTLIER Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.99 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.72 12.15 3.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.693 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.843 HG12 ' H ' ' A' ' 82' ' ' ALA . 21.8 t -129.58 179.64 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.502 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.843 ' H ' HG12 ' A' ' 81' ' ' VAL . . . -141.19 143.51 34.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.726 0.298 . . . . 0.0 110.67 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.783 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -130.96 125.78 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.739 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.91 HD23 HG12 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -113.12 96.98 6.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.115 179.51 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.975 HD12 ' HB2' ' A' ' 56' ' ' CYS . 1.7 mp -95.6 128.89 42.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.892 0.377 . . . . 0.0 111.494 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.947 ' CD2' HG21 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -159.84 119.67 2.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.989 179.493 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.837 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -111.69 149.67 31.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.047 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.717 ' HB2' ' HE1' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.325 0 CA-C-O 121.326 0.584 . . . . 0.0 110.587 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.407 ' HD3' HH11 ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.783 0.325 . . . . 0.0 111.038 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.642 ' O ' ' HB2' ' B' ' 6' ' ' ALA . 0.0 OUTLIER -47.74 118.51 2.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.763 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.936 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.67 -179.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.765 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.705 HG23 ' O ' ' B' ' 77' ' ' TYR . 41.2 t -145.06 63.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.921 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.5 OUTLIER -33.49 148.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.442 -179.845 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.588 ' HG2' ' O ' ' B' ' 8' ' ' ILE . 13.9 mmtt -148.21 -1.86 0.54 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.929 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.483 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 0.3 OUTLIER -175.22 83.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.761 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.752 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -123.7 113.51 18.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.831 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.901 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 94.7 m-20 -110.65 37.7 2.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.984 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 17' ' ' MET . 17.3 ttp -125.68 170.97 11.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.075 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.712 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.44 141.84 14.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.827 179.877 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.661 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 17.7 mp0 -50.89 -60.53 2.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.896 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 1.3 mt-10 -54.24 -20.73 7.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.536 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -82.67 -34.57 27.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.866 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 1.036 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.69 -36.97 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.823 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.763 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 3.2 mp0 -77.06 -40.72 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.519 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 5.0 m-20 -67.05 -34.01 76.77 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.468 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.853 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -65.5 -46.65 78.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.034 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.845 HG22 ' CD2' ' B' ' 76' ' ' PHE . 73.3 t -56.28 -42.38 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.242 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.763 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 24.1 mt-10 -60.6 -39.4 87.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.333 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.539 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 4.1 t -66.51 -32.97 74.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 110.097 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.78 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -73.22 -32.15 64.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.977 ' HA ' HD12 ' B' ' 29' ' ' LEU . 90.1 m -72.43 -39.53 67.78 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.312 -1.313 . . . . 0.0 109.639 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.789 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 80.7 mm-40 -58.11 -46.1 86.13 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.315 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.997 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -67.93 -29.09 68.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.843 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.988 HD11 ' HG ' ' B' ' 78' ' ' LEU . 4.5 mt -65.36 -57.11 9.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.664 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -34.48 71.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.803 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.789 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 16.0 mmtt -79.83 -28.78 40.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.676 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.552 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -167.56 133.63 2.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.183 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.404 ' ND2' ' H ' ' B' ' 33' ' ' ASN . 2.4 p30 -97.47 26.25 5.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.564 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 1.019 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 10.3 mm -95.84 109.98 23.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.743 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.906 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 0.5 OUTLIER -29.73 -70.37 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.116 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.616 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -50.67 -56.52 11.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.916 0.388 . . . . 0.0 110.557 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 1.019 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -43.99 -64.17 0.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.541 179.806 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.997 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 7.0 mt -45.49 -52.96 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.671 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.911 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -51.4 -39.16 56.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.825 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -66.89 -63.38 1.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.573 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.672 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.5 OUTLIER -42.84 -47.34 5.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.518 179.672 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.78 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 32.5 mt -61.74 -70.44 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.393 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.766 ' HB3' ' CE2' ' A' ' 65' ' ' TYR . 0.5 OUTLIER -36.49 -58.98 0.68 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.478 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 1.6 tttm -51.38 -42.28 61.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.54 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.771 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -70.45 -42.25 71.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.358 -179.458 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.853 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -63.56 -35.78 81.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.014 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.801 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -68.84 -46.43 68.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.698 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.4 ' N ' ' CG ' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -78.16 -25.49 47.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.219 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.771 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -89.7 -16.9 29.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.122 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.749 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 53.6 m-85 -125.93 -72.01 0.67 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.455 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.749 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 52.7 t30 160.09 108.55 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.801 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 62.4 Cg_exo -35.02 157.23 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.562 2.174 . . . . 0.0 112.63 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.929 HG21 HG21 ' A' ' 67' ' ' THR . 0.3 OUTLIER -121.92 120.13 33.56 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 122.809 0.444 . . . . 0.0 110.611 -0.005 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.836 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 33.8 m95 -88.69 155.29 19.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.278 0.561 . . . . 0.0 111.491 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.815 ' CE1' HG22 ' A' ' 67' ' ' THR . 3.7 m-70 -136.03 99.11 4.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.265 -0.88 . . . . 0.0 108.888 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.998 ' O ' HD13 ' B' ' 57' ' ' ILE . 2.3 m -108.08 151.51 25.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 1.113 HG21 HG21 ' A' ' 57' ' ' ILE . 18.1 mm -135.46 108.15 8.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.629 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 0.911 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.1 p -111.1 125.78 68.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -178.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.894 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -146.63 -96.1 0.18 Allowed Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.196 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.627 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 16.5 ptt85 169.27 -27.82 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 120.813 0.339 . . . . 0.0 111.088 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.475 ' O ' ' OD1' ' B' ' 61' ' ' ASN . 24.4 t-20 -160.47 42.41 0.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.982 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.6 p90 -96.65 -165.02 1.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.875 0.369 . . . . 0.0 110.784 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.522 ' HA3' ' HB3' ' A' ' 35' ' ' GLU . . . -141.08 111.57 0.72 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.795 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.955 ' CA ' HD12 ' A' ' 57' ' ' ILE . 88.4 p -101.1 128.32 47.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.084 0.469 . . . . 0.0 111.596 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.797 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 48.0 t80 -136.41 67.62 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.143 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.861 HG13 HD11 ' A' ' 57' ' ' ILE . 10.3 m -103.28 169.86 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.376 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 1.014 HG21 HG21 ' A' ' 53' ' ' THR . 59.6 m -117.34 80.64 1.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.71 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.834 ' HE1' ' HB ' ' B' ' 70' ' ' THR . 59.7 t-80 -57.37 -129.19 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.945 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.574 ' N ' ' ND1' ' B' ' 68' ' ' HIS . 6.7 pt-20 161.32 -47.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.027 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.834 ' HB ' ' HE1' ' B' ' 68' ' ' HIS . 4.0 m -87.73 -111.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.613 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.584 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -56.97 4.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.66 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.901 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 0.1 OUTLIER 72.4 -74.77 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.64 0.257 . . . . 0.0 110.549 -179.879 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.767 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 4.3 p90 154.94 173.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.215 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 1.036 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -147.17 119.28 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.922 0.391 . . . . 0.0 111.246 179.511 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.764 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 1.4 t80 -103.79 136.55 43.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.351 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.921 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.38 129.19 5.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.975 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.705 ' O ' HG23 ' B' ' 7' ' ' VAL . 2.4 t80 -97.16 113.38 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 0.988 ' HG ' HD11 ' B' ' 29' ' ' LEU . 0.9 OUTLIER -69.47 170.54 10.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.42 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.506 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.54 -41.55 0.01 OUTLIER Glycine 0 C--N 1.33 0.242 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.958 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.521 ' N ' ' O ' ' B' ' 78' ' ' LEU . 51.6 mt-30 -154.02 35.4 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.894 HG13 ' O ' ' B' ' 59' ' ' GLY . 58.6 t -151.16 170.91 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.024 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.942 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.61 154.13 46.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.299 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.942 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -142.71 126.57 14.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.418 . . . . 0.0 111.56 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 1.04 HD23 HG12 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -118.57 95.71 4.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.201 179.439 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.936 HD12 ' HB3' ' B' ' 56' ' ' CYS . 1.7 mp -93.65 123.74 37.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.368 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.756 ' CD1' HG21 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -162.53 123.23 2.48 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.558 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.836 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 2.2 ptmt -100.59 143.78 30.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.956 0.407 . . . . 0.0 110.974 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.502 ' H ' ' CD2' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -107.23 18.92 21.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.321 0.581 . . . . 0.0 110.48 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.4 -1.222 . . . . 0.0 112.431 -179.946 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 6' ' ' ALA . 8.1 mmmm . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.743 0.306 . . . . 0.0 110.652 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.081 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 56.72 144.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.216 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.506 HG12 ' HE2' ' A' ' 9' ' ' LYS . 21.4 t -107.69 78.29 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.969 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.995 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -46.38 154.42 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.051 0.453 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.506 ' HE2' HG12 ' A' ' 7' ' ' VAL . 5.6 mmtt -138.53 -19.4 1.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.27 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.485 HD22 ' HA ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -168.27 98.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.535 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.85 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -112.13 75.47 0.92 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.748 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.757 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 7.4 m-20 -75.17 38.54 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.251 0.548 . . . . 0.0 109.618 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.871 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -136.26 172.12 13.47 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.626 -179.113 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.871 ' N ' ' HG2' ' A' ' 13' ' ' MET . 8.3 t -54.24 134.74 44.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.285 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.777 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -51.36 -78.95 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.337 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.497 ' HG2' ' N ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -43.33 -27.42 0.25 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.979 0.419 . . . . 0.0 110.352 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.835 ' HG2' ' CG ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -78.71 -35.06 45.45 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.047 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.85 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -74.58 -31.62 62.12 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.818 0.342 . . . . 0.0 110.398 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -72.28 -40.9 67.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -66.65 -29.67 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.529 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.727 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -66.58 -45.61 78.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.049 179.081 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.764 HG22 ' CD2' ' A' ' 76' ' ' PHE . 84.7 t -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.477 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -58.15 -36.84 73.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.953 0.406 . . . . 0.0 110.081 179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.8 t -67.37 -32.68 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.047 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.766 ' C ' HD12 ' A' ' 29' ' ' LEU . . . -73.56 -40.27 64.06 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.874 ' HA ' HD12 ' A' ' 29' ' ' LEU . 87.1 m -64.55 -37.71 88.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.271 -1.332 . . . . 0.0 109.43 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -61.26 -43.09 99.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.493 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.795 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -76.69 -14.5 59.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.996 179.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.874 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.4 mt -82.53 -44.99 15.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.777 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -34.51 64.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.241 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 3.1 mttm -79.13 -28.65 42.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.649 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.636 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.68 149.07 27.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.94 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -116.37 33.53 5.5 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.053 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.976 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 5.7 mm -112.95 107.86 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.964 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.916 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 35.5 mp0 -29.95 -74.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.904 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.505 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -43.54 -59.46 2.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.691 179.767 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.976 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -45.2 -63.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.544 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.795 HG23 ' CB ' ' A' ' 28' ' ' ALA . 7.5 mt -46.79 -52.22 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.126 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 1.076 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -54.16 -36.7 63.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.101 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.805 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -66.23 -67.28 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.115 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.689 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -46.14 -39.93 10.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.754 HG13 ' O ' ' A' ' 38' ' ' ILE . 65.6 mt -62.8 -66.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.966 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.892 ' HE3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -46.61 -47.05 20.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 47' ' ' ASP . 0.8 OUTLIER -52.85 -63.47 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.677 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 4.5 tp10 -45.61 -58.02 3.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.378 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.727 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 2.1 m-85 -52.93 -39.72 63.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.594 179.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.799 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 3.9 t70 -62.12 -24.96 67.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.345 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.805 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -118.4 4.76 11.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.799 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.625 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -107.74 -14.22 14.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.938 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.797 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 5.6 m-85 -145.51 -63.14 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.24 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.797 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 10.7 p-10 157.0 117.16 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.148 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.799 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 13.8 Cg_endo -56.18 174.82 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.47 2.113 . . . . 0.0 112.22 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 23.4 m -103.66 123.16 46.48 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.14 0.576 . . . . 0.0 110.577 0.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.817 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 51.5 m95 -96.77 126.95 42.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.18 0.514 . . . . 0.0 112.181 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.749 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -106.82 96.99 6.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.504 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.939 ' O ' HD13 ' A' ' 57' ' ' ILE . 18.9 p -111.4 147.08 35.99 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.963 ' CG1' HD23 ' A' ' 84' ' ' LEU . 18.3 mm -133.03 109.67 14.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.304 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.076 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.1 p -109.42 124.62 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 111.796 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.84 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -146.65 -135.76 2.78 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.061 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -160.89 -20.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.749 0.309 . . . . 0.0 111.312 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.708 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 8.8 m-20 -154.91 35.37 0.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.355 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.917 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 11.2 p90 -101.66 -178.29 3.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.71 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.815 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.73 107.59 0.61 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.82 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.889 ' CB ' HD12 ' B' ' 57' ' ' ILE . 53.6 p -92.41 130.37 38.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.207 0.527 . . . . 0.0 111.713 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.808 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 48.5 t80 -136.67 72.06 1.42 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.099 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.046 HG13 HD11 ' B' ' 57' ' ' ILE . 5.9 m -122.38 136.53 58.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.294 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 1.055 HG21 HG21 ' B' ' 53' ' ' THR . 7.0 t -67.94 116.78 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.972 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.46 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 21.4 p-80 -87.21 162.83 17.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.736 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.517 ' O ' HG23 ' A' ' 70' ' ' THR . 6.3 pt-20 -158.57 -153.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.949 0.404 . . . . 0.0 111.166 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.517 HG23 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 44.06 -92.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.772 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 170.64 21.02 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.659 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.851 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 25.5 m-70 -125.18 61.96 1.18 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.12 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.757 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 7.4 t80 -130.76 97.82 4.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.933 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.926 HG23 ' HE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -115.42 122.88 70.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.804 -179.163 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.593 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 8.0 t80 -114.04 137.11 52.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.299 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.995 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -161.0 173.23 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.183 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.706 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 89.2 t80 -132.87 92.47 3.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.908 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.081 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.1 mm? -42.75 169.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.59 -44.14 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.424 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.443 ' O ' ' OE1' ' A' ' 80' ' ' GLN . 0.9 OUTLIER -148.37 32.62 0.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.84 HG13 ' O ' ' A' ' 59' ' ' GLY . 76.4 t -147.46 171.66 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.65 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.711 ' C ' HD13 ' A' ' 83' ' ' ILE . . . -133.51 144.79 49.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.82 0.343 . . . . 0.0 110.745 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.711 HD13 ' C ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -134.53 124.64 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.077 -179.752 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.963 HD23 ' CG1' ' A' ' 57' ' ' ILE . 0.9 OUTLIER -112.72 88.34 2.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.556 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.79 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -93.35 124.19 37.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.472 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CE1' ' HB2' ' A' ' 55' ' ' HIS . 2.5 p90 -164.11 129.04 2.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.591 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.798 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.53 161.59 13.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.503 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.668 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 0.0 110.434 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.558 HH11 ' CB ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.735 0.302 . . . . 0.0 110.682 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.529 ' O ' ' HD2' ' B' ' 5' ' ' LYS . 0.0 OUTLIER -112.02 40.52 2.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.088 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -115.42 -170.92 1.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.336 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.782 HG12 ' HE3' ' B' ' 9' ' ' LYS . 26.8 t -137.98 66.69 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.801 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.9 OUTLIER -37.21 157.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.132 0.491 . . . . 0.0 110.663 -179.829 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.782 ' HE3' HG12 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -154.44 -11.4 0.13 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.201 179.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.519 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.2 OUTLIER -166.8 100.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.433 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.843 ' HB1' ' NE2' ' B' ' 18' ' ' GLN . . . -128.77 136.77 50.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.019 0.438 . . . . 0.0 111.599 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.572 ' CB ' ' HD2' ' B' ' 68' ' ' HIS . 21.1 t70 -132.63 28.7 4.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.774 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.824 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 13.5 ttp -123.98 151.58 43.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.856 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.783 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 2.1 m -36.52 141.39 0.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.942 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' B' ' 18' ' ' GLN . 11.9 mt-10 -46.94 -66.45 0.4 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.184 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.706 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -50.93 -30.57 15.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.773 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.796 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.13 -40.75 74.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.743 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.843 ' NE2' ' HB1' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -66.78 -28.67 68.58 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.849 0.357 . . . . 0.0 110.469 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.706 ' HG2' ' O ' ' B' ' 16' ' ' GLU . 2.6 pt20 -77.36 -42.55 36.08 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.625 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 1.1 m-20 -69.9 -25.03 63.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.79 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.827 ' OG ' HG21 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -70.87 -51.52 25.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.196 179.278 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.818 ' HA ' ' CZ ' ' B' ' 76' ' ' PHE . 60.9 t -57.17 -42.39 79.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.244 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 8.7 mt-10 -61.42 -38.88 88.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.077 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.421 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 65.9 m -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.964 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.76 ' C ' HD12 ' B' ' 29' ' ' LEU . . . -70.23 -33.63 71.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.581 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 1.4 m -66.84 -40.76 88.05 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.43 -1.259 . . . . 0.0 109.487 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 5.6 mt-30 -56.57 -44.92 81.46 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.562 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.729 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -80.25 -15.23 57.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.565 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.886 HD21 HG11 ' B' ' 81' ' ' VAL . 5.7 mt -82.57 -35.71 26.9 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . 0.641 ' OE1' ' HD2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -88.07 -30.19 20.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.188 -179.717 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.641 ' HD2' ' OE1' ' B' ' 30' ' ' GLU . 1.7 mptt -84.39 -9.75 58.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.834 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.611 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.1 OUTLIER -151.1 -150.09 0.33 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.975 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.494 HD22 ' HA ' ' B' ' 33' ' ' ASN . 0.0 OUTLIER 177.87 28.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.609 179.843 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 1.037 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.8 mm -117.8 106.4 19.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.509 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.815 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 2.3 mp0 -29.67 -62.65 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.924 0.392 . . . . 0.0 110.731 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.626 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -55.1 -51.97 64.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.017 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 1.037 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.5 m-20 -54.44 -61.3 2.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.828 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.875 ' HB ' HG11 ' B' ' 58' ' ' VAL . 2.5 mt -45.78 -48.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.008 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 1.034 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -62.42 -34.2 76.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.808 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -62.4 -62.91 1.43 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.034 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.608 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -53.72 -54.13 42.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.939 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.765 HD11 HG22 ' B' ' 38' ' ' ILE . 73.7 mt -44.06 -66.65 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.277 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.712 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 13.2 tttp -42.82 -50.97 5.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.903 0.382 . . . . 0.0 110.917 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.529 ' HZ2' ' HB3' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -55.9 -45.9 78.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.219 -179.79 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.686 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.0 mt-10 -68.09 -34.88 77.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.15 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.788 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -72.32 -32.63 66.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.991 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.733 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 5.1 m-20 -71.31 -38.0 71.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.915 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.48 -23.67 20.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.688 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.686 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.4 OUTLIER -86.03 -20.53 28.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.359 -179.562 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.555 ' HD2' ' O ' ' B' ' 46' ' ' PHE . 12.7 m-85 -132.09 -66.82 0.69 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.617 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.492 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 3.4 t-20 158.93 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.395 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.733 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 20.8 Cg_endo -60.3 171.61 3.11 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.307 2.005 . . . . 0.0 112.333 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 1.055 HG21 HG21 ' A' ' 67' ' ' THR . 62.9 m -104.74 131.57 52.02 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 122.917 0.487 . . . . 0.0 111.052 0.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.826 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 46.2 m95 -102.2 157.58 16.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.591 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.771 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 10.2 m-70 -128.91 99.57 5.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.755 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.665 ' O ' HD13 ' B' ' 57' ' ' ILE . 1.8 m -106.26 128.26 53.84 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 1.046 HD11 HG13 ' A' ' 66' ' ' VAL . 17.0 mm -125.32 101.38 8.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.501 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.034 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.7 p -108.77 126.24 65.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 0.0 111.85 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.771 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -144.08 -105.29 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.795 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.842 ' HG3' HD22 ' B' ' 61' ' ' ASN . 0.4 OUTLIER 170.91 -33.26 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.67 0.271 . . . . 0.0 111.194 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.842 HD22 ' HG3' ' B' ' 60' ' ' ARG . 7.0 m-80 -145.02 46.72 1.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.125 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.917 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 21.3 p90 -111.0 -173.54 2.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.904 0.383 . . . . 0.0 110.76 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.916 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -138.0 98.53 0.26 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.778 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.916 ' CA ' HD12 ' A' ' 57' ' ' ILE . 1.2 p -86.81 121.99 30.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.223 0.535 . . . . 0.0 111.591 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.892 ' HE2' ' HE3' ' A' ' 43' ' ' LYS . 21.8 t80 -129.14 75.53 1.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.791 HG13 HD11 ' A' ' 57' ' ' ILE . 28.4 m -123.48 164.62 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.336 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.593 HG21 HG21 ' A' ' 53' ' ' THR . 5.3 t -82.91 128.17 34.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.669 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.572 ' HD2' ' CB ' ' B' ' 12' ' ' ASP . 1.8 p-80 -104.11 118.57 36.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.557 ' O ' ' HB ' ' B' ' 70' ' ' THR . 0.8 OUTLIER -123.29 168.73 12.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.707 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.557 ' HB ' ' O ' ' B' ' 69' ' ' GLU . 29.0 m 76.13 -100.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.716 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.631 ' O ' ' HA ' ' B' ' 13' ' ' MET . 2.3 ttpt 173.33 38.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.798 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.826 ' HB3' ' CZ3' ' B' ' 54' ' ' TRP . 3.2 m-70 -138.66 46.87 1.97 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.794 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 4.8 t80 -120.69 87.67 2.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.404 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.827 HG21 ' OG ' ' B' ' 21' ' ' SER . 1.2 tt -105.48 144.91 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.045 0.45 . . . . 0.0 111.632 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.8 OUTLIER -134.1 131.18 38.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.195 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.818 ' CZ ' ' HA ' ' B' ' 22' ' ' VAL . 9.7 p90 -158.54 161.7 37.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.991 0.425 . . . . 0.0 111.258 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.737 ' O ' HG23 ' B' ' 7' ' ' VAL . 8.0 t80 -122.23 111.02 16.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.411 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.088 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.41 169.97 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.767 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -23.39 -45.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 113.15 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.581 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 14.3 tt0 -151.4 36.74 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.752 0.311 . . . . 0.0 110.937 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.886 HG11 HD21 ' B' ' 29' ' ' LEU . 86.0 t -152.12 170.18 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.184 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.824 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -133.85 149.94 51.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.824 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -140.11 131.56 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.188 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.982 HD23 ' CG1' ' B' ' 57' ' ' ILE . 2.0 tp -121.34 88.58 2.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.794 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 1.3 mp -92.93 124.54 36.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.069 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.783 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 12.1 p90 -162.72 132.83 4.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.349 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.799 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -93.82 151.87 19.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.534 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.687 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.1 OUTLIER -113.99 19.72 16.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.314 0.578 . . . . 0.0 110.17 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.397 -1.224 . . . . 0.0 112.436 -179.866 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.414 ' O ' HD13 ' A' ' 78' ' ' LEU . 6.1 tptm . . . . . 0 C--O 1.232 0.166 0 CA-C-O 120.877 0.37 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.043 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -136.5 175.3 9.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.212 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.522 ' O ' ' HE3' ' A' ' 9' ' ' LYS . 95.9 t -137.31 77.94 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.758 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.808 HD12 ' HB3' ' A' ' 76' ' ' PHE . 1.2 mp -32.78 148.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.334 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.774 ' HB2' ' CD2' ' A' ' 75' ' ' TYR . 5.0 mmtp -129.45 -14.19 4.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.847 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 1.7 t30 -164.09 -91.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.483 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.993 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 70.09 -173.96 0.18 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.577 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.617 ' HB3' ' HB3' ' A' ' 72' ' ' HIS . 2.8 t0 166.62 28.51 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.471 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.648 ' HG2' ' CB ' ' A' ' 17' ' ' MET . 15.4 ttp -113.76 171.58 7.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.674 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.901 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 1.9 m -48.35 129.17 15.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.877 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.501 ' H ' ' HG2' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -34.39 -79.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.795 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.64 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 2.1 mm-40 -46.07 -22.89 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.901 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -76.14 -39.89 53.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.549 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.835 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -68.47 -38.16 80.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.495 179.625 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.443 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 1.0 OUTLIER -72.98 -36.74 67.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.566 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.64 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.4 t0 -66.78 -39.58 87.86 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.84 179.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.985 ' HB2' HD22 ' A' ' 85' ' ' LEU . 1.1 p -60.35 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.74 178.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.809 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 40.1 t -52.74 -50.24 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.303 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 54.2 mt-10 -54.3 -46.78 72.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.22 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.434 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 20.0 m -59.29 -37.31 77.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.034 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.774 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.04 -28.32 66.45 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.8 m -72.93 -39.43 66.28 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.4 -1.273 . . . . 0.0 109.54 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.699 ' O ' ' HD3' ' A' ' 31' ' ' LYS . 6.3 mm-40 -56.79 -43.22 80.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.406 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.966 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -75.99 -29.94 58.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.178 179.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 1.074 HD21 HG11 ' A' ' 81' ' ' VAL . 3.1 mt -72.71 -30.52 64.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.212 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -95.96 -16.11 21.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.831 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.699 ' HD3' ' O ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -92.5 -23.93 18.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.554 ' HE1' ' HA ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -163.49 134.84 4.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.754 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -96.11 39.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.894 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.713 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 40.2 mm -117.59 102.16 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.001 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.653 ' OE2' ' HD3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -22.25 -89.43 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.423 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -37.03 -42.88 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.727 179.967 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.713 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 24.2 t0 -57.96 -56.54 20.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.517 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.966 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.8 mt -52.04 -45.72 41.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.838 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -61.87 -45.72 92.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.802 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -56.2 -64.34 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.286 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.909 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -38.8 -52.68 1.72 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.02 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.902 HG21 HD11 ' A' ' 85' ' ' LEU . 16.9 mt -55.91 -68.17 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.203 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.61 ' HE2' ' C ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -37.34 -63.03 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.204 -179.848 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -43.92 -57.19 3.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.418 . . . . 0.0 111.037 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.586 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -53.51 -57.03 12.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.205 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.797 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -55.03 -34.82 63.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.554 ' HB2' ' CE ' ' A' ' 43' ' ' LYS . 17.6 t70 -73.54 -20.88 60.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.57 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.74 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -121.38 10.53 10.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.586 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.8 OUTLIER -128.18 3.35 5.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.547 -179.431 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.58 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 95.7 m-85 -147.07 -63.12 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.497 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 18.8 p-10 161.56 110.87 0.01 OUTLIER Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.109 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.483 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 86.1 Cg_exo -45.96 151.06 1.55 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.311 2.008 . . . . 0.0 112.578 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.684 HG21 HG21 ' B' ' 67' ' ' THR . 95.1 m -118.74 136.17 54.11 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.162 0.585 . . . . 0.0 110.353 -0.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.809 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 65.3 m95 -101.48 144.8 29.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.27 0.557 . . . . 0.0 111.993 -179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.771 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.2 OUTLIER -130.26 103.39 6.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.847 178.854 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.851 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.37 162.64 18.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.404 0.621 . . . . 0.0 112.496 -178.176 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.993 HD12 ' HA ' ' B' ' 64' ' ' SER . 26.2 mm -131.77 172.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.977 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.937 HG11 ' HB ' ' A' ' 38' ' ' ILE . 7.3 p -169.33 114.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.946 0.403 . . . . 0.0 111.563 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.569 ' HA2' ' CG ' ' A' ' 35' ' ' GLU . . . -141.07 -140.06 3.78 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.801 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.653 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -162.78 6.09 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.427 ' O ' ' OE2' ' B' ' 35' ' ' GLU . 0.6 OUTLIER -179.99 32.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.76 0.314 . . . . 0.0 111.205 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.955 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -101.12 -169.1 1.65 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.097 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.606 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.41 93.98 0.17 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.849 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.783 ' HB3' HD13 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -82.72 134.15 35.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 0.0 111.498 -179.244 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.761 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 19.7 t80 -143.34 65.29 1.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.256 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.813 HG21 ' CE2' ' A' ' 86' ' ' PHE . 2.8 m -113.94 153.7 15.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.357 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.607 HG22 ' CE1' ' B' ' 55' ' ' HIS . 3.4 t -62.57 -162.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.951 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.621 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -156.85 150.16 24.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.915 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.733 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -143.48 175.03 10.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 179.894 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 72' ' ' HIS . 3.5 m 42.37 -114.57 0.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.662 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.857 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 4.2 mmtm -69.87 24.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.762 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 51.1 m-70 62.54 -88.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.69 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.762 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 0.2 OUTLIER 162.58 -169.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.604 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.993 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -161.12 141.37 3.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.443 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.774 ' CD2' ' HB2' ' A' ' 9' ' ' LYS . 7.8 t80 -131.54 139.47 49.25 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.787 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.809 ' CE2' ' HA ' ' A' ' 22' ' ' VAL . 0.2 OUTLIER -161.55 176.42 11.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.845 0.355 . . . . 0.0 111.097 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.751 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 42.4 t80 -135.48 97.21 3.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.201 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.043 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -60.3 -169.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.457 179.695 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.565 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -61.73 93.08 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.07 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.565 ' HB2' ' O ' ' A' ' 79' ' ' GLY . 4.8 mm100 71.1 15.9 6.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.117 0.484 . . . . 0.0 110.268 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 1.074 HG11 HD21 ' A' ' 29' ' ' LEU . 55.2 t -136.84 164.91 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.775 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.814 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -138.37 151.87 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.69 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.874 ' CD1' HG23 ' A' ' 58' ' ' VAL . 0.2 OUTLIER -140.41 126.42 21.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.884 0.374 . . . . 0.0 111.398 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.9 HD23 HG12 ' A' ' 57' ' ' ILE . 0.9 OUTLIER -112.02 93.37 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.985 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -92.21 147.44 22.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.173 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.813 ' CE2' HG21 ' A' ' 66' ' ' VAL . 5.9 p90 179.33 119.02 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.182 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.857 ' HZ3' ' HG2' ' A' ' 71' ' ' LYS . 2.3 ptmt -101.12 150.97 22.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.733 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.5 OUTLIER . . . . . 0 C--N 1.33 -0.274 0 CA-C-O 121.242 0.544 . . . . 0.0 110.911 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.494 ' HD2' HE22 ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.143 0 CA-C-O 120.874 0.368 . . . . 0.0 110.831 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.498 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.6 OUTLIER 32.49 40.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.261 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.049 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -131.78 -176.27 3.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.278 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.557 ' N ' ' O ' ' B' ' 77' ' ' TYR . 45.0 t -145.73 72.41 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.922 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.807 HD12 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -33.15 147.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 110.583 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.546 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 0.5 OUTLIER -134.35 -12.39 2.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.686 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 173.6 103.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.826 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.686 ' HB1' ' HG2' ' B' ' 18' ' ' GLN . . . -130.4 154.12 48.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.454 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.945 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 26.6 m-20 -146.98 27.51 1.06 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.339 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.91 ' SD ' ' HG3' ' B' ' 71' ' ' LYS . 10.7 ttp -108.26 178.02 4.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.598 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.764 ' H ' ' HG3' ' B' ' 13' ' ' MET . 3.5 m -58.76 128.6 38.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.806 0.336 . . . . 0.0 111.015 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.663 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . 1.6 mt-10 -33.35 -70.06 0.08 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.747 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 3.4 mm-40 -55.22 -26.51 39.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.272 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.793 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 38.5 mmm -72.56 -34.67 67.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.822 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.96 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.41 -48.62 39.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.022 0.439 . . . . 0.0 110.663 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.768 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 2.2 mm100 -68.3 -23.43 64.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.779 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER -79.11 -34.89 43.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.86 179.166 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.897 ' OG ' HG21 ' B' ' 74' ' ' ILE . 0.2 OUTLIER -65.96 -41.49 91.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.883 179.075 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.887 HG22 ' CD2' ' B' ' 76' ' ' PHE . 95.4 t -63.85 -50.17 78.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.262 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.768 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 39.7 mt-10 -51.94 -40.91 61.56 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.491 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.744 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 48.6 t -66.7 -37.59 85.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.321 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.749 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -69.56 -28.8 66.29 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.618 ' HA ' HD12 ' B' ' 29' ' ' LEU . 4.7 m -70.82 -43.31 68.88 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 114.329 -1.305 . . . . 0.0 109.513 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.744 ' HG3' ' HA ' ' B' ' 24' ' ' CYS . 6.1 mt-30 -53.5 -47.3 69.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.717 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.872 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -76.21 -20.19 57.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.632 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.734 ' CD1' ' HG ' ' B' ' 78' ' ' LEU . 5.9 mt -74.89 -39.89 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.272 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.47 -30.56 27.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.382 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.561 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 7.2 mttt -82.04 -33.34 30.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.0 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.622 ' CG ' ' HE1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -144.44 157.12 44.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.642 HD22 HD13 ' B' ' 34' ' ' ILE . 0.3 OUTLIER -123.54 29.36 6.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.214 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 1.094 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 4.0 mm -107.68 108.0 24.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.7 ' O ' HG13 ' B' ' 58' ' ' VAL . 0.3 OUTLIER -29.79 -71.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.132 -179.512 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.52 ' HG2' ' H ' ' B' ' 36' ' ' LYS . 0.5 OUTLIER -50.03 -54.67 18.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.866 0.365 . . . . 0.0 110.647 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 1.094 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.3 m-20 -46.11 -64.65 0.7 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.911 ' HB ' HG11 ' B' ' 58' ' ' VAL . 4.8 mt -44.56 -56.01 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.253 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 1.006 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.88 -38.32 70.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.471 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.761 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -57.59 -58.83 6.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.218 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.684 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -58.07 -33.93 69.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.13 -179.82 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.767 HG13 ' O ' ' B' ' 38' ' ' ILE . 62.5 mt -66.05 -69.51 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.572 ' HB3' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -45.11 -37.28 4.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.962 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.606 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 43.3 mmtt -71.14 -51.67 23.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 111.023 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.505 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.6 mt-10 -62.69 -25.58 68.23 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.947 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.805 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -75.61 -47.49 26.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.617 179.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.74 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.9 OUTLIER -64.94 -24.68 67.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.304 179.642 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.716 ' HE2' ' C ' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -89.85 -42.76 11.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.625 179.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.668 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.8 tttp -83.0 -14.17 54.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.05 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.779 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 58.0 m-85 -128.88 -71.38 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.435 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.747 HD22 ' HD2' ' B' ' 52' ' ' PRO . 1.9 t-20 156.22 119.22 0.0 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.18 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.747 ' HD2' HD22 ' B' ' 51' ' ' ASN . 19.0 Cg_endo -59.23 168.9 4.27 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 122.495 2.13 . . . . 0.0 112.661 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.452 HG21 HG21 ' A' ' 67' ' ' THR . 1.7 t -108.5 125.31 51.66 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 122.885 0.474 . . . . 0.0 110.54 0.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.808 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 42.8 m95 -95.92 168.56 10.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.584 0.707 . . . . 0.0 112.107 -179.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.755 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 8.4 m-70 -131.09 96.19 3.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.584 178.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.597 ' O ' ' HB1' ' B' ' 39' ' ' ALA . 78.9 m -104.44 122.49 45.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.201 0.524 . . . . 0.0 112.116 -178.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.783 HD13 ' HB3' ' A' ' 64' ' ' SER . 7.7 mt -127.77 109.16 19.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.382 179.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.006 HG12 ' HB2' ' B' ' 39' ' ' ALA . 1.6 p -111.04 118.65 57.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.321 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.929 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -138.79 -126.15 2.37 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.889 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.728 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -169.7 10.03 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.687 0.28 . . . . 0.0 111.147 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.728 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.1 OUTLIER 163.64 32.82 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.994 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.955 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.2 p90 -82.86 173.08 12.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.023 0.439 . . . . 0.0 111.004 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.94 76.88 0.32 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.894 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.993 ' HA ' HD12 ' A' ' 57' ' ' ILE . 53.1 p -72.52 122.2 20.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 0.0 111.415 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.802 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 23.3 t80 -133.92 77.39 1.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.309 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.969 HG21 ' CZ ' ' B' ' 86' ' ' PHE . 6.1 m -115.14 163.89 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.497 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.684 HG21 HG21 ' A' ' 53' ' ' THR . 19.7 m -95.62 73.33 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.464 179.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.62 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 2.9 p-80 -46.57 179.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.4 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.62 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -179.49 -177.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.467 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.527 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 56.13 -120.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.818 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.91 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.72 17.42 0.07 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.943 0.402 . . . . 0.0 110.672 179.82 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.945 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 7.0 m-70 68.53 -90.36 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.827 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.744 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 1.0 OUTLIER 157.87 -164.68 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.566 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.96 HD12 ' CA ' ' B' ' 18' ' ' GLN . 0.2 OUTLIER -162.76 116.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.479 ' OH ' ' CZ ' ' B' ' 62' ' ' PHE . 1.1 t80 -107.02 134.65 49.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.29 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.887 ' CD2' HG22 ' B' ' 22' ' ' VAL . 2.9 p90 -152.35 165.34 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.086 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.589 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 26.7 t80 -126.33 108.95 11.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.049 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -69.86 170.47 11.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.763 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.477 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.97 -37.34 0.01 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.917 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.589 ' N ' ' O ' ' B' ' 78' ' ' LEU . 4.6 tt0 -158.5 41.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.745 0.307 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.929 HG13 ' O ' ' B' ' 59' ' ' GLY . 69.8 t -157.79 164.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.009 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.596 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -133.44 111.74 10.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.662 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.749 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -101.33 133.37 44.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.973 0.416 . . . . 0.0 111.482 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.622 HD23 HG13 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -119.74 103.92 9.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.156 179.628 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.744 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 4.3 mp -107.22 117.11 33.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.52 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.969 ' CZ ' HG21 ' B' ' 66' ' ' VAL . 25.1 p90 -153.34 138.39 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.925 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.808 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 5.3 mtpm? -100.65 159.63 15.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 111.207 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.43 19.33 14.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.818 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . 0.409 ' CA ' ' OG1' ' B' ' 70' ' ' THR . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.424 -1.209 . . . . 0.0 112.567 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.419 ' C ' HD13 ' A' ' 78' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.968 0.413 . . . . 0.0 110.73 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.047 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -123.9 -178.82 4.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.205 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.793 HG12 ' HE2' ' A' ' 9' ' ' LYS . 93.3 t -133.92 73.86 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.009 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.819 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -39.59 155.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.267 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.793 ' HE2' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -146.41 -10.03 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.567 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.442 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER 179.11 97.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.632 179.813 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 1.048 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -127.44 94.95 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.666 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 72' ' ' HIS . 88.1 m-20 -90.33 30.93 1.05 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.285 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.913 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.1 OUTLIER -116.59 166.83 11.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.644 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.89 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -45.65 122.94 3.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.797 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.636 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -38.01 -73.58 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.948 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.48 ' OE1' ' HA ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -44.52 -28.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.754 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.913 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -73.02 -43.63 61.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.812 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 1.048 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -59.9 -36.39 76.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.725 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.462 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 6.7 mt-30 -75.43 -39.77 58.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.137 0.494 . . . . 0.0 109.923 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.409 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -68.48 -29.01 67.53 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.41 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.833 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -68.53 -45.92 70.95 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.785 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 18' ' ' GLN . 17.4 t -56.55 -44.19 80.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.211 178.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 62.0 mt-10 -59.61 -41.58 90.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.269 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.739 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 53.6 t -65.08 -34.69 79.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.257 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.81 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -73.14 -32.98 65.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.622 ' HA ' HD12 ' A' ' 29' ' ' LEU . 23.5 m -70.22 -36.9 74.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.565 178.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.815 ' HB3' ' NE2' ' A' ' 41' ' ' HIS . 0.2 OUTLIER -62.31 -42.28 99.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.758 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.92 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -69.88 -28.94 66.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.859 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.81 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.5 mt -71.12 -58.7 3.3 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.813 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -36.61 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.859 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.788 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 15.1 mmtp -79.45 -35.77 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.887 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.605 ' HE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -153.56 152.11 30.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.886 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.93 ' HA ' HD11 ' A' ' 38' ' ' ILE . 4.7 m120 -128.46 40.37 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.534 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.707 HG22 ' O ' ' A' ' 34' ' ' ILE . 33.2 mm -107.5 49.26 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.232 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.855 ' HG3' ' HA2' ' A' ' 59' ' ' GLY . 0.0 OUTLIER 34.72 -89.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.378 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.603 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -41.33 -46.9 3.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.987 0.422 . . . . 0.0 110.52 179.338 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.622 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 61.0 t0 -54.19 -61.13 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.81 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.93 HD11 ' HA ' ' A' ' 33' ' ' ASN . 3.5 mt -48.12 -50.72 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.078 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 1.031 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -52.13 -51.47 57.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.803 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -52.79 -51.31 61.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.698 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.851 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.6 OUTLIER -52.14 -47.0 65.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.55 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.931 HG21 HD11 ' A' ' 85' ' ' LEU . 37.1 mt -55.17 -71.88 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.189 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.784 ' HB3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -37.61 -55.2 1.14 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -44.26 -62.35 1.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.13 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.773 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 1.3 tp10 -55.54 -62.04 1.95 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.091 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.1 m-85 -41.67 -49.61 4.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.949 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.788 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 1.6 m-20 -56.58 -39.74 74.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.1 6.54 43.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.248 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.773 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -108.89 -20.72 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.098 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CE2' ' CD2' ' A' ' 46' ' ' PHE . 14.1 m-85 -140.62 -58.55 0.52 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.417 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.651 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 0.4 OUTLIER 159.21 118.37 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.292 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.788 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 29.3 Cg_endo -62.39 171.37 5.48 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 122.561 2.174 . . . . 0.0 112.407 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.795 HG21 HG21 ' B' ' 67' ' ' THR . 20.6 m -104.9 134.46 47.97 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 122.981 0.512 . . . . 0.0 110.648 0.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.807 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.6 m95 -105.7 145.45 31.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.49 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.853 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 5.6 m170 -121.69 101.8 7.81 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.869 ' O ' HD13 ' A' ' 57' ' ' ILE . 8.6 p -107.66 146.79 31.56 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.087 HD12 ' HB2' ' B' ' 64' ' ' SER . 29.6 mm -134.47 107.37 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.548 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.031 HG12 ' HB2' ' A' ' 39' ' ' ALA . 7.2 p -107.86 116.35 51.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.545 -179.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.94 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -134.97 -134.11 3.35 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.192 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.715 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -167.36 11.12 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 120.827 0.346 . . . . 0.0 111.137 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.715 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 29.1 t-20 165.55 31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.909 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 3.0 p90 -91.32 -175.28 4.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.781 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.65 ' N ' ' HD1' ' A' ' 62' ' ' PHE . . . -138.41 101.32 0.32 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.87 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.98 ' CB ' HD12 ' B' ' 57' ' ' ILE . 87.6 p -87.45 144.88 26.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.196 0.522 . . . . 0.0 111.72 -179.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.759 ' H ' HD13 ' B' ' 57' ' ' ILE . 22.9 t80 -152.2 64.95 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.012 HG13 HD11 ' B' ' 57' ' ' ILE . 27.2 m -104.8 160.73 5.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.6 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.819 HG21 HG21 ' B' ' 53' ' ' THR . 2.3 m -87.0 -17.79 32.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.96 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.835 ' HB3' ' HB2' ' A' ' 86' ' ' PHE . 6.4 p-80 35.55 -157.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.714 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER 167.6 -155.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.91 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.533 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 41.65 -98.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.671 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.579 ' O ' ' HB2' ' A' ' 13' ' ' MET . 1.4 mmtp -91.27 32.83 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.712 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.726 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.0 OUTLIER 52.99 -88.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.95 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.726 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 28.0 p90 165.46 -174.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.007 0.432 . . . . 0.0 111.125 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 1.0 HG23 ' HE1' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -154.03 129.69 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.887 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.593 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -117.05 137.23 52.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.496 179.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 1.0 ' HE1' HG23 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -162.46 163.7 27.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.902 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.767 ' HE1' ' HA ' ' A' ' 80' ' ' GLN . 6.3 t80 -130.55 103.64 6.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.156 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.047 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.0 mm? -60.21 -178.82 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.833 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.02 -53.56 0.08 OUTLIER Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.54 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.767 ' HA ' ' HE1' ' A' ' 77' ' ' TYR . 0.3 OUTLIER -147.77 34.47 0.84 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.014 0.435 . . . . 0.0 110.415 179.468 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.94 HG13 ' O ' ' A' ' 59' ' ' GLY . 91.5 t -143.69 167.61 12.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.912 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.821 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -131.68 151.97 51.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.542 179.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.821 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.1 OUTLIER -138.84 134.06 42.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.995 0.426 . . . . 0.0 111.375 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.925 HD23 ' CG1' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -122.5 91.65 3.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.957 179.532 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.931 HD11 HG21 ' A' ' 42' ' ' ILE . 2.1 mp -93.71 125.28 38.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.63 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.835 ' HB2' ' HB3' ' A' ' 68' ' ' HIS . 27.9 p90 -158.95 122.54 3.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.807 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 40.3 mtpt -80.4 165.44 22.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.615 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.853 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 121.243 0.544 . . . . 0.0 110.634 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.854 HH11 ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.997 0.427 . . . . 0.0 110.723 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.644 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.1 OUTLIER -42.67 129.66 4.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.051 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.752 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.93 165.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.88 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.646 ' CG1' ' HE2' ' B' ' 9' ' ' LYS . 71.7 t -132.17 66.98 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.945 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.956 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.08 153.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.185 0.517 . . . . 0.0 110.731 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.748 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 0.9 OUTLIER -154.01 -4.95 0.17 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.565 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.1 OUTLIER -173.12 86.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.361 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.978 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -121.24 84.71 2.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.947 -179.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.531 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 0.3 OUTLIER -75.9 40.57 0.2 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.408 179.205 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.718 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 16.5 ttp -132.11 166.21 22.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.791 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.0 m -52.25 143.56 14.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.929 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 10.9 mt-10 -48.31 -65.82 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.993 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.482 ' H ' ' HG3' ' B' ' 16' ' ' GLU . 0.1 OUTLIER -51.74 -29.25 17.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.852 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.657 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -72.98 -32.04 64.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.86 ' NE2' ' HB1' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -76.1 -34.87 59.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.674 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.676 ' HG3' ' NH1' ' B' ' 4' ' ' ARG . 2.6 mp0 -75.8 -38.28 58.35 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.36 -30.85 66.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.652 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.772 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 77.5 p -67.77 -44.48 77.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.819 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' B' ' 76' ' ' PHE . 81.4 t -59.48 -50.19 80.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.477 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -55.0 -40.64 70.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.305 179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 9.1 m -65.61 -35.24 80.24 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.813 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.673 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -71.8 -30.28 65.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.605 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 34.3 m -72.68 -39.35 67.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.593 178.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.671 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -55.99 -45.34 79.02 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.237 178.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.69 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -76.13 -22.17 55.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.042 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.881 HD21 HG11 ' B' ' 81' ' ' VAL . 4.6 mt -75.46 -34.17 60.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.651 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -90.0 -25.12 21.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.931 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.802 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.8 mmtm -85.2 -27.62 26.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.531 179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.802 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -151.81 163.39 39.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.464 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.431 ' CG ' ' O ' ' B' ' 33' ' ' ASN . 28.4 t-20 -128.39 39.25 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.085 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.975 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 18.2 mm -120.54 104.41 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.9 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.727 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 0.8 OUTLIER -29.64 -66.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.045 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.756 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -51.75 -50.43 60.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.791 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.975 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.6 OUTLIER -53.84 -61.99 1.94 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.905 0.383 . . . . 0.0 110.44 179.695 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.861 ' HB ' HG11 ' B' ' 58' ' ' VAL . 5.0 mt -44.46 -48.65 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.017 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.878 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -58.98 -43.63 91.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.152 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.739 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -55.58 -64.51 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.921 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.69 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -51.31 -57.17 9.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.755 HD11 HG22 ' B' ' 38' ' ' ILE . 87.8 mt -43.52 -62.67 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.679 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 4.6 tttt -53.93 -30.67 47.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.576 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' B' ' 41' ' ' HIS . 3.9 mttt -68.38 -48.55 64.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.207 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.466 ' O ' ' CB ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -68.11 -42.16 80.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.665 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.772 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -63.26 -33.39 75.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.892 -179.922 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.785 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.7 OUTLIER -71.11 -49.22 46.6 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.96 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.403 ' HA ' ' HE3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -79.14 -21.67 46.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.549 -179.485 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.804 ' O ' ' HD3' ' B' ' 49' ' ' LYS . 0.4 OUTLIER -90.53 -30.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.609 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.559 ' HD2' ' HA ' ' B' ' 46' ' ' PHE . 87.4 m-85 -115.52 -64.48 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.747 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 1.2 t-20 158.94 114.37 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.183 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 85.1 Cg_exo -47.3 152.83 2.06 Favored 'Trans proline' 0 CA--C 1.533 0.426 0 C-N-CA 122.284 1.99 . . . . 0.0 112.659 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.819 HG21 HG21 ' A' ' 67' ' ' THR . 8.9 t -122.82 126.0 46.54 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 122.921 0.488 . . . . 0.0 111.036 0.116 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.999 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 44.5 m95 -90.62 117.16 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.747 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.782 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -96.07 109.16 21.62 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.497 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 1.095 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.5 OUTLIER -123.52 149.91 44.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.354 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 1.012 HD11 HG13 ' A' ' 66' ' ' VAL . 23.2 mm -130.76 109.79 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 0.878 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.8 p -110.27 125.67 67.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.93 0.395 . . . . 0.0 111.232 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.731 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -138.37 -128.28 2.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.965 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.746 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.6 OUTLIER -165.3 5.78 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.707 0.289 . . . . 0.0 111.613 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.746 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 2.0 t-20 164.32 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.81 0.338 . . . . 0.0 110.974 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.909 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -87.4 -171.15 3.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.043 0.449 . . . . 0.0 110.845 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.606 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -136.97 77.58 0.34 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.884 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 1.087 ' HB2' HD12 ' A' ' 57' ' ' ILE . 5.8 p -70.55 142.21 51.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.031 0.444 . . . . 0.0 111.23 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.863 ' H ' HD13 ' A' ' 57' ' ' ILE . 48.8 t80 -146.04 76.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.356 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.994 HG13 HD11 ' A' ' 57' ' ' ILE . 4.4 m -125.02 131.08 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.272 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.795 HG21 HG21 ' A' ' 53' ' ' THR . 2.6 t -78.31 130.61 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.024 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.494 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.1 OUTLIER -72.65 177.45 4.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.673 ' O ' HG23 ' B' ' 70' ' ' THR . 0.7 OUTLIER -163.97 38.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.247 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.673 HG23 ' O ' ' B' ' 69' ' ' GLU . 0.1 OUTLIER 178.99 -113.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.134 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.535 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -158.63 25.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.792 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 1.0 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 17.1 m80 -124.58 44.82 2.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.795 ' HA ' ' HA ' ' B' ' 86' ' ' PHE . 8.1 t80 -124.33 90.51 3.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.545 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.978 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.8 OUTLIER -106.74 132.04 55.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.047 0.451 . . . . 0.0 111.508 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.699 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 18.3 t80 -119.78 134.04 55.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.818 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.956 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.1 OUTLIER -161.37 166.84 26.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.984 0.421 . . . . 0.0 111.16 -179.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.621 ' HB3' ' HB ' ' B' ' 7' ' ' VAL . 6.4 t80 -128.06 111.7 13.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.894 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 0.752 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.62 166.52 18.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.458 179.763 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.43 -60.85 0.1 Allowed Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.502 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.81 36.15 3.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.288 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.881 HG11 HD21 ' B' ' 29' ' ' LEU . 68.9 t -152.15 169.78 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.566 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.713 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -137.02 147.49 46.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.983 0.42 . . . . 0.0 110.998 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.741 HG13 ' CE2' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -133.26 131.7 58.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.074 -179.812 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.971 HD23 ' CG1' ' B' ' 57' ' ' ILE . 3.3 tp -123.83 83.73 2.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.701 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 1.095 HD12 ' HB2' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -87.45 131.85 34.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.007 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.795 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -160.98 125.6 3.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 1.0 ' HB2' ' HB2' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -105.54 143.75 33.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.737 179.879 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.782 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -91.47 19.47 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.251 0.548 . . . . 0.0 110.735 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . 0.618 ' O ' ' HE2' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.447 -1.196 . . . . 0.0 112.511 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.413 ' HD2' ' HA ' ' A' ' 5' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.985 0.422 . . . . 0.0 110.683 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.075 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.61 169.19 12.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.564 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 47.6 t -120.96 82.8 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.904 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -55.18 136.52 17.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.117 0.484 . . . . 0.0 110.639 -179.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.564 ' HE2' ' CG1' ' A' ' 7' ' ' VAL . 0.5 OUTLIER -125.19 -12.85 6.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.041 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.6 ' O ' ' N ' ' A' ' 75' ' ' TYR . 29.9 t30 -176.51 122.85 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.356 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.82 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -149.89 91.03 1.74 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.816 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -75.32 28.52 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.139 0.495 . . . . 0.0 109.841 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.889 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 2.0 ttm -114.14 163.28 15.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.77 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.777 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.2 OUTLIER -56.9 137.78 54.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.644 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.1 mp0 -41.76 -78.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 16' ' ' GLU . 2.8 mm-40 -40.02 -27.29 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.779 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.842 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.4 -42.44 53.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.849 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.883 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -64.85 -32.86 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.894 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -76.28 -42.04 46.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.157 0.503 . . . . 0.0 109.717 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.49 -30.73 67.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.669 179.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.823 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 21.9 t -66.84 -45.1 79.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 18' ' ' GLN . 46.8 t -59.98 -46.74 93.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.31 -40.74 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.071 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.786 ' HA ' ' HG3' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -66.23 -38.45 87.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.079 179.361 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.724 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -68.61 -26.93 65.61 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.547 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.3 m -73.84 -40.23 63.46 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.795 178.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.786 ' HG3' ' HA ' ' A' ' 24' ' ' CYS . 7.0 mt-30 -56.87 -44.34 82.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.75 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.853 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -79.45 -21.83 44.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.544 179.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 1.093 HD21 HG11 ' A' ' 81' ' ' VAL . 6.5 mt -73.25 -44.09 60.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.084 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -81.48 -29.64 33.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.075 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.493 ' CB ' ' CE1' ' A' ' 32' ' ' TYR . 2.4 mttm -77.77 -36.13 50.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.757 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.627 ' CD1' ' N ' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -150.33 151.8 33.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.815 179.693 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 1.043 ' HA ' HD11 ' A' ' 38' ' ' ILE . 1.6 m-80 -125.88 35.44 4.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.074 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.978 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 36.2 mm -98.44 32.09 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.099 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.756 ' N ' HD12 ' A' ' 38' ' ' ILE . 4.1 mp0 41.24 -86.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.376 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.615 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.75 -50.98 5.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.307 179.26 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.978 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.9 OUTLIER -53.99 -54.24 41.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.323 179.368 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 1.043 HD11 ' HA ' ' A' ' 33' ' ' ASN . 4.7 mt -54.33 -59.08 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.829 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 1.015 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -48.74 -40.38 28.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.779 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -54.66 -67.59 0.25 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.81 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.624 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -49.05 -45.72 43.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.76 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.796 HD11 HG22 ' A' ' 38' ' ' ILE . 58.7 mt -49.96 -48.8 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.969 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.651 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 8.4 tmtt? -66.81 -59.64 3.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.472 ' O ' ' OD1' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -40.04 -57.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.958 0.409 . . . . 0.0 110.971 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.697 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 1.6 tp10 -60.93 -38.25 85.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.263 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.823 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -69.19 -27.23 65.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.085 -179.651 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.816 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -90.3 -13.95 34.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 0.0 110.414 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.609 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -111.39 -8.8 14.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.611 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.725 ' HD2' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -106.56 -23.1 12.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.216 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.725 ' CE1' ' HD2' ' A' ' 49' ' ' LYS . 3.9 m-85 -123.94 -62.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.518 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.483 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 1.3 t30 156.19 121.98 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.973 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.816 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 31.4 Cg_endo -63.03 172.26 5.17 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.646 2.231 . . . . 0.0 112.686 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.553 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 36.0 m -102.08 133.72 46.47 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 122.819 0.448 . . . . 0.0 110.492 -0.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.767 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 56.0 m95 -104.23 140.23 38.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.286 0.565 . . . . 0.0 112.147 -179.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.862 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.6 OUTLIER -130.43 99.83 5.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.212 -0.903 . . . . 0.0 108.811 178.767 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 1.063 ' HB2' HD12 ' A' ' 85' ' ' LEU . 0.5 OUTLIER -116.89 167.81 10.79 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -177.648 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.958 HD13 ' O ' ' A' ' 56' ' ' CYS . 17.5 mm -135.14 156.49 39.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.789 178.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.015 HG12 ' HB2' ' A' ' 39' ' ' ALA . 10.0 p -158.9 109.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.935 0.397 . . . . 0.0 111.629 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.855 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -139.44 -130.76 2.75 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.019 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.628 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -164.04 -28.9 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 120.737 0.303 . . . . 0.0 111.416 -179.678 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.45 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 53.0 t30 -152.88 45.98 0.69 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.964 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 1.009 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -103.0 -163.26 0.98 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.973 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.817 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.43 90.84 0.15 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.073 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.96 ' HA ' HG12 ' B' ' 57' ' ' ILE . 3.3 p -78.28 147.05 34.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.407 . . . . 0.0 111.22 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.828 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 13.2 t80 -154.6 62.61 0.67 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.645 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.74 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 4.5 m -124.59 140.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.324 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.901 ' CG2' HG21 ' B' ' 53' ' ' THR . 15.2 t -86.16 149.91 24.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.706 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.429 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -78.3 -157.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.937 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.1 OUTLIER -140.86 -51.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.764 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 t -141.01 -60.37 0.49 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.868 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.764 ' HG2' ' C ' ' A' ' 70' ' ' THR . 0.0 OUTLIER -157.03 -136.88 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.776 -179.933 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.853 ' HA ' ' HG3' ' A' ' 13' ' ' MET . 2.9 m-70 31.75 35.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.889 ' N ' ' HB2' ' A' ' 13' ' ' MET . 6.5 t80 -116.73 100.69 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.748 0.309 . . . . 0.0 110.735 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.815 HD11 HD11 ' A' ' 8' ' ' ILE . 2.4 tt -117.19 153.17 18.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.969 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 10' ' ' ASN . 10.0 t80 -149.83 93.23 2.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.66 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.904 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -113.78 -176.17 2.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.33 -179.51 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.623 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 31.1 t80 -143.0 91.03 2.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.811 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.075 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -49.4 174.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.927 -179.945 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.461 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.19 -59.95 0.26 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.577 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.427 ' HB3' HE21 ' A' ' 80' ' ' GLN . 0.0 OUTLIER -133.57 34.05 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.753 0.311 . . . . 0.0 110.729 179.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 1.093 HG11 HD21 ' A' ' 29' ' ' LEU . 96.2 t -148.97 164.22 4.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.272 -179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.992 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -129.95 153.18 48.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.59 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.992 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.1 OUTLIER -144.5 118.49 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.373 . . . . 0.0 111.039 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.868 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 6.5 tp -107.48 86.55 2.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 1.063 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -87.75 138.69 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.466 -179.868 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.719 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -175.5 125.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.321 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.767 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 53.1 mtpt -82.12 -171.7 3.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.797 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.937 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 2.2 m . . . . . 0 C--N 1.327 -0.409 0 CA-C-O 121.305 0.574 . . . . 0.0 110.353 179.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.493 ' HB2' ' H ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.821 0.343 . . . . 0.0 110.973 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.666 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.2 OUTLIER 59.78 108.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.051 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.21 -168.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.633 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.78 HG12 ' HE2' ' B' ' 9' ' ' LYS . 10.5 t -157.03 73.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.901 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.853 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -38.16 150.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.78 ' HE2' HG12 ' B' ' 7' ' ' VAL . 63.2 mmtt -146.9 -3.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.485 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.0 OUTLIER 179.02 83.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.147 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.861 ' HB1' ' NE2' ' B' ' 18' ' ' GLN . . . -109.63 72.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.794 -179.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.766 ' HB2' ' HD2' ' B' ' 73' ' ' PHE . 0.6 OUTLIER -73.52 33.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.752 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.954 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -129.56 172.05 11.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.716 -178.782 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.872 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.98 133.21 32.83 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.94 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.787 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 3.2 mp0 -51.64 -69.43 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.408 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -52.21 -29.83 24.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.517 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.825 ' HG2' ' CG ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -75.17 -32.79 61.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.968 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.861 ' NE2' ' HB1' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -76.06 -28.59 57.69 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.854 0.359 . . . . 0.0 110.352 179.271 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.487 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 5.2 mm100 -72.87 -40.29 65.76 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.545 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 8.7 m-20 -68.33 -30.59 69.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.17 178.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -62.97 -48.7 77.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.976 178.97 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.954 HG22 ' CD2' ' B' ' 76' ' ' PHE . 95.5 t -55.25 -51.86 51.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.006 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 7.9 mt-10 -54.77 -36.34 64.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.862 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -36.18 70.41 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.657 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -70.65 -23.14 62.46 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.524 ' HA ' HD12 ' B' ' 29' ' ' LEU . 6.5 m -78.59 -42.2 29.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.599 178.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.78 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -54.04 -46.54 71.91 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.59 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.891 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -69.73 -36.77 76.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.005 178.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.655 HD11 ' HG ' ' B' ' 78' ' ' LEU . 5.8 mt -58.27 -53.0 63.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.026 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.608 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.78 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 11.0 mmmt -75.99 -25.68 56.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.3 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.513 ' CG ' ' C ' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -171.92 133.51 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.868 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -92.76 26.58 2.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.043 0.449 . . . . 0.0 110.601 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.662 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 42.8 mm -96.39 103.57 14.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.688 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 1.032 ' HG3' ' HA2' ' B' ' 59' ' ' GLY . 0.2 OUTLIER -30.05 -70.46 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.556 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -48.15 -53.77 15.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.806 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.662 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 18.3 t0 -48.77 -62.17 1.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.63 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.969 ' HB ' HG11 ' B' ' 58' ' ' VAL . 16.6 mt -44.12 -50.78 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.047 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.81 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -54.58 -47.54 73.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.984 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.828 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -60.01 -50.83 72.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.626 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.803 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.0 OUTLIER -52.9 -50.63 63.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.718 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.689 HD11 HG22 ' B' ' 38' ' ' ILE . 19.2 mt -59.97 -70.5 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.641 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.733 ' HD2' ' CE2' ' A' ' 65' ' ' TYR . 0.6 OUTLIER -38.54 -33.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.93 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.431 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 18.2 tttp -68.92 -60.45 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.034 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.764 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 3.0 mm-40 -62.29 -24.8 67.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.881 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -76.73 -38.81 53.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.605 179.759 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.608 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.6 OUTLIER -66.11 -35.59 80.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.714 179.791 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.505 ' HE2' ' HB3' ' B' ' 48' ' ' LYS . 3.0 mmmm -88.6 -32.51 18.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.764 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -76.35 -25.44 54.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.894 179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.702 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 26.0 m-85 -130.45 -68.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.702 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 1.4 t30 155.02 119.2 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.188 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.619 ' CB ' ' HA ' ' B' ' 53' ' ' THR . 20.7 Cg_endo -60.4 175.73 1.03 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.326 2.018 . . . . 0.0 112.346 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.901 HG21 ' CG2' ' A' ' 67' ' ' THR . 2.0 m -100.51 131.44 46.43 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.951 0.5 . . . . 0.0 110.547 0.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.818 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 64.6 m95 -103.14 100.86 10.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.007 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.74 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 20.5 m170 -73.45 94.37 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.982 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.5 OUTLIER -111.22 154.28 24.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.276 0.56 . . . . 0.0 112.148 -177.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.96 HG12 ' HA ' ' A' ' 64' ' ' SER . 29.9 mt -151.15 110.84 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.71 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 0.969 HG11 ' HB ' ' B' ' 38' ' ' ILE . 1.4 p -107.03 131.61 56.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.187 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 1.032 ' HA2' ' HG3' ' B' ' 35' ' ' GLU . . . -149.46 -134.06 2.28 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.842 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.429 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 1.5 ptm180 -161.51 1.66 0.06 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 120.704 0.288 . . . . 0.0 111.105 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.488 ' O ' ' CD ' ' A' ' 35' ' ' GLU . 1.2 t-20 174.55 34.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.162 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 1.009 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 54.8 p90 -90.48 174.48 7.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 0.0 110.76 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.626 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -123.02 74.17 0.39 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.035 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.889 ' HA ' HG23 ' A' ' 57' ' ' ILE . 28.4 p -74.35 102.76 4.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.879 0.371 . . . . 0.0 111.087 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.818 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 12.7 t80 -109.47 67.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.939 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.983 HG21 ' CE1' ' B' ' 86' ' ' PHE . 18.6 m -101.14 165.65 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.026 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.786 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 2.3 m -115.15 95.52 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.973 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.631 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.0 OUTLIER -54.17 175.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.885 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.677 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.4 OUTLIER -168.76 80.02 0.14 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.977 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.65 HG23 ' H ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 163.62 -97.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.901 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.726 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -175.72 16.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.552 179.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.954 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 93.5 m-70 -126.93 69.47 1.27 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.864 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.0 t80 -128.83 75.33 1.63 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.507 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.827 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 1.2 tt -91.23 129.38 42.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.376 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.682 ' CD1' ' HB2' ' B' ' 84' ' ' LEU . 17.1 t80 -128.29 87.45 2.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.489 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.954 ' CD2' HG22 ' B' ' 22' ' ' VAL . 4.8 p90 -109.7 164.27 12.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.24 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.711 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 53.8 t80 -123.38 114.79 20.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.71 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.051 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.57 166.14 19.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.823 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.483 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -30.81 -36.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.66 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -151.33 30.73 0.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.914 0.388 . . . . 0.0 110.777 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.755 ' HB ' ' HB2' ' B' ' 78' ' ' LEU . 42.5 t -146.0 168.84 6.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.915 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.711 ' HB2' ' HD2' ' B' ' 77' ' ' TYR . . . -137.34 109.22 7.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.322 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.73 HD13 HG23 ' B' ' 58' ' ' VAL . 0.9 OUTLIER -101.25 133.78 43.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.239 0.542 . . . . 0.0 112.068 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.733 ' O ' HD12 ' B' ' 85' ' ' LEU . 0.1 OUTLIER -119.28 132.27 55.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.873 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.982 HD12 ' HB2' ' B' ' 56' ' ' CYS . 3.2 mp -137.35 101.5 4.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.983 ' CE1' HG21 ' B' ' 66' ' ' VAL . 12.5 p90 -139.61 123.87 17.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.97 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.805 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -91.8 159.18 15.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.677 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 1.3 m -117.64 19.95 13.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.31 0.576 . . . . 0.0 110.246 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.55 -179.891 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.565 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.846 0.355 . . . . 0.0 111.166 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.025 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -139.09 170.43 15.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.456 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 26.3 t -131.15 85.81 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.043 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.853 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -49.32 156.54 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.193 0.521 . . . . 0.0 110.826 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.74 ' HD3' ' O ' ' A' ' 8' ' ' ILE . 1.2 mmtp -144.78 -14.93 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.935 179.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.77 77.97 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.396 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.867 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -101.78 76.33 1.63 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.673 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.497 ' OD2' ' CD2' ' A' ' 68' ' ' HIS . 59.3 t0 -77.93 30.25 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.132 0.491 . . . . 0.0 109.973 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.922 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.4 OUTLIER -121.91 163.34 19.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 -179.481 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.841 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -50.13 128.43 19.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.976 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.771 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.3 mm-40 -37.83 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.022 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.797 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.9 OUTLIER -44.33 -31.1 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.922 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -70.94 -37.01 72.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.249 179.535 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.867 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -68.54 -30.29 69.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.475 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -76.77 -38.3 54.34 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.44 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.4 -25.75 62.47 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.655 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.844 ' OG ' HG21 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -72.96 -50.66 22.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.106 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.855 HG23 ' O ' ' A' ' 18' ' ' GLN . 17.2 t -60.15 -38.27 76.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.528 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.716 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 47.5 mt-10 -67.15 -38.66 85.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.897 179.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.5 m -70.18 -34.77 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.606 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.845 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -72.52 -36.38 68.31 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.706 ' HA ' HD12 ' A' ' 29' ' ' LEU . 52.0 m -69.05 -36.5 77.75 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.565 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -61.5 -39.35 90.65 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.479 178.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.973 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -71.92 -28.75 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.604 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.845 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.2 mt -72.7 -41.39 65.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.81 -32.75 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.152 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HB3' ' CE2' ' A' ' 32' ' ' TYR . 1.2 mtpp -86.71 -26.59 24.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.043 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.603 ' HE1' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.18 178.18 10.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.746 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 1.062 ' HA ' HD11 ' A' ' 38' ' ' ILE . 0.4 OUTLIER -158.39 40.19 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.02 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.006 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 42.0 mm -103.61 39.28 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.652 ' HB3' ' C ' ' B' ' 62' ' ' PHE . 4.5 mp0 43.33 -86.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.252 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.606 ' N ' ' O ' ' A' ' 34' ' ' ILE . 2.9 mtpt -48.82 -33.36 10.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.874 0.369 . . . . 0.0 110.228 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 1.006 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -65.88 -45.66 81.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.264 179.472 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 1.062 HD11 ' HA ' ' A' ' 33' ' ' ASN . 2.8 mp -65.1 -38.4 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.473 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.941 ' HB1' ' HB2' ' B' ' 65' ' ' TYR . . . -61.53 -43.13 99.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.424 179.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.739 ' HB2' ' CE1' ' B' ' 65' ' ' TYR . . . -62.38 -55.76 24.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.284 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.935 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.7 OUTLIER -47.81 -47.08 31.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.461 179.328 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.822 HG12 ' HA ' ' A' ' 25' ' ' ALA . 14.1 mt -67.18 -69.25 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.138 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.636 ' HG3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -43.42 -35.27 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.056 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.511 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -66.21 -62.19 1.62 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.821 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.641 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 13.5 mt-10 -52.98 -51.24 62.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.815 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -53.12 -52.14 59.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.79 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -57.43 -27.03 62.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.027 -179.876 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -113.94 9.61 17.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.147 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.641 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -121.73 -5.12 9.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.111 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.613 ' CD1' ' HA ' ' A' ' 46' ' ' PHE . 11.5 m-85 -148.56 -61.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.307 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.538 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 1.2 p-10 161.45 117.08 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.445 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.79 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 33.2 Cg_endo -64.23 167.21 15.0 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.449 2.099 . . . . 0.0 112.568 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.884 HG21 HG21 ' B' ' 67' ' ' THR . 4.9 t -109.54 122.28 47.07 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.757 0.423 . . . . 0.0 110.773 -0.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.703 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 28.4 m95 -89.7 135.86 33.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.841 -179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.831 ' CE1' HG22 ' B' ' 67' ' ' THR . 0.0 OUTLIER -102.21 104.84 15.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.161 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.594 ' HB3' HD12 ' A' ' 85' ' ' LEU . 1.6 m -113.11 125.14 54.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.121 0.486 . . . . 0.0 112.171 -178.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.736 HG12 ' HA ' ' B' ' 64' ' ' SER . 13.4 mt -126.42 99.73 5.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.781 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.841 HG11 ' HB ' ' A' ' 38' ' ' ILE . 3.3 p -99.63 123.54 52.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.996 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.771 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -146.0 -150.69 5.25 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.171 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.751 ' HG3' HH11 ' A' ' 60' ' ' ARG . 0.0 OUTLIER -158.28 13.5 0.19 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.676 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 35.1 t30 174.08 35.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.449 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.933 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -100.06 157.78 16.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.152 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.91 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -114.73 83.75 0.34 Allowed Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.858 ' CB ' HD12 ' B' ' 57' ' ' ILE . 84.5 p -79.78 137.94 37.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.1 0.476 . . . . 0.0 111.75 -178.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.911 ' HB2' ' HB1' ' B' ' 39' ' ' ALA . 1.5 t80 -141.35 58.09 1.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.263 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.791 HG21 ' CE1' ' A' ' 86' ' ' PHE . 27.5 m -104.94 129.63 57.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.039 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.504 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 5.2 m -81.7 123.76 29.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.497 ' CD2' ' OD2' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -71.79 172.92 8.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.613 179.743 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.537 ' O ' ' HB ' ' A' ' 70' ' ' THR . 7.3 pt-20 -169.74 75.09 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.066 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.776 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 1.5 t 165.58 -104.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 70' ' ' THR . 17.3 mtmt -171.91 18.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.814 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.744 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 66.5 m-70 -130.56 67.47 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.707 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.689 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 1.8 t80 -133.16 93.42 3.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.597 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.844 HG21 ' OG ' ' A' ' 21' ' ' SER . 3.2 tt -108.96 122.69 64.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.323 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.759 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 34.9 t80 -116.11 88.51 2.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.453 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.853 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -113.3 168.85 9.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.934 0.397 . . . . 0.0 111.411 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.692 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 10.0 t80 -130.09 100.51 5.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.725 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.025 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.1 mm? -53.95 172.15 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -36.09 -36.57 0.14 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.689 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.522 ' O ' HG23 ' A' ' 81' ' ' VAL . 6.7 tp60 -151.5 41.23 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.915 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.656 HG13 ' O ' ' A' ' 59' ' ' GLY . 42.1 t -158.6 166.54 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.014 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.692 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -134.33 110.12 9.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.602 HD13 HG23 ' A' ' 58' ' ' VAL . 0.3 OUTLIER -99.71 118.1 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.038 0.447 . . . . 0.0 111.597 -179.28 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.759 ' HB2' ' CE1' ' A' ' 75' ' ' TYR . 1.6 tp -102.74 90.68 3.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.111 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.689 ' O ' ' HA ' ' A' ' 73' ' ' PHE . 0.6 OUTLIER -99.23 124.62 44.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.478 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.791 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.3 p90 -168.57 132.72 1.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.209 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.683 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -92.94 168.2 11.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.847 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.633 ' CB ' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.27 0 CA-C-O 121.168 0.509 . . . . 0.0 110.826 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.441 ' O ' HG11 ' B' ' 22' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.812 0.339 . . . . 0.0 110.505 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.675 ' HE3' ' H ' ' B' ' 6' ' ' ALA . 0.0 OUTLIER 57.42 -168.04 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.34 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.122 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 57.94 -178.34 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.514 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.757 ' O ' ' HD2' ' B' ' 9' ' ' LYS . 80.3 t -147.78 75.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.776 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.887 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -44.28 153.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.008 0.432 . . . . 0.0 110.211 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.767 ' HD2' ' HA ' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -135.29 -22.92 1.51 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.242 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.598 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 2.2 t-20 -145.74 -104.66 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.998 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.756 ' CB ' ' HA ' ' B' ' 74' ' ' ILE . . . 76.19 129.64 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.08 0.467 . . . . 0.0 112.091 178.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.711 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -124.49 35.22 4.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.169 179.094 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.695 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 23.0 ttp -121.28 158.2 28.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.962 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.707 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -38.87 158.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 179.747 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.69 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 13.1 mt-10 -67.17 -57.39 6.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.011 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.1 OUTLIER -55.75 -24.82 37.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.658 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.695 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -78.35 -43.53 27.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.856 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -60.75 -37.79 82.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.923 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.406 ' HG2' ' NE ' ' B' ' 4' ' ' ARG . 0.4 OUTLIER -74.74 -42.21 58.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.181 0.515 . . . . 0.0 109.907 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.64 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -65.19 -31.87 73.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.904 179.1 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.911 ' HB2' HD22 ' B' ' 85' ' ' LEU . 1.0 OUTLIER -66.01 -49.4 67.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.978 179.172 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.992 HG22 ' CD2' ' B' ' 76' ' ' PHE . 92.5 t -53.28 -46.52 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.672 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 5.0 mm-40 -61.94 -35.81 79.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.416 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.513 ' HB3' HG23 ' B' ' 42' ' ' ILE . 0.8 OUTLIER -70.48 -32.43 69.95 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.005 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.88 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.99 -40.59 68.45 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.659 ' HA ' HD12 ' B' ' 29' ' ' LEU . 85.2 m -64.94 -42.51 94.58 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.876 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.534 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 23.5 mt-30 -55.1 -46.84 75.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.853 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.885 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -63.45 -32.62 74.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.38 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.88 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.0 OUTLIER -68.51 -51.39 43.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.186 -179.778 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -33.25 71.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.969 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.421 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 13.1 mttt -82.88 -35.09 26.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.77 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.487 ' HE2' ' HB2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -146.64 150.87 36.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.737 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.661 ' C ' HD13 ' B' ' 34' ' ' ILE . 0.1 OUTLIER -114.97 32.05 6.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.007 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.967 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.1 mm -114.93 110.97 33.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.82 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.91 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 3.4 mp0 -29.99 -70.79 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.24 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.912 ' HE3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -46.23 -48.25 17.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.738 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.967 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -56.9 -62.16 1.94 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.631 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.885 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 4.2 mt -45.82 -45.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 1.069 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -59.35 -55.33 36.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.713 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.794 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -51.02 -45.07 61.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.667 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.845 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.5 t60 -59.1 -50.95 72.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.787 HG12 ' HA ' ' B' ' 25' ' ' ALA . 26.0 mt -60.71 -70.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.288 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.653 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 1.5 ttpt -37.19 -57.14 0.89 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.54 -44.67 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.087 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.2 OUTLIER -63.8 -33.72 76.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.759 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.761 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -74.67 -36.38 62.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.702 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.79 ' OD2' ' HB3' ' B' ' 52' ' ' PRO . 0.2 OUTLIER -68.82 -35.71 77.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.953 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.461 ' HE3' ' HB3' ' B' ' 48' ' ' LYS . 17.6 mmmt -90.75 -38.76 12.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.774 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.569 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.0 OUTLIER -77.79 -22.42 50.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.887 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.77 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 77.7 m-85 -120.61 -71.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.77 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.5 t-20 158.54 118.68 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.79 ' HB3' ' OD2' ' B' ' 47' ' ' ASP . 10.6 Cg_endo -53.3 167.21 0.86 Allowed 'Trans proline' 0 CA--C 1.534 0.484 0 C-N-CA 122.438 2.092 . . . . 0.0 112.791 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.64 HG22 ' NE2' ' B' ' 55' ' ' HIS . 16.3 m -104.68 131.37 52.19 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.774 0.43 . . . . 0.0 110.55 0.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.764 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 60.4 m95 -105.81 139.36 40.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.358 0.599 . . . . 0.0 111.884 -179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.827 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.1 98.76 4.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.642 178.662 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.777 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 0.4 OUTLIER -119.87 162.03 19.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.453 0.644 . . . . 0.0 112.485 -177.795 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.881 ' HB ' ' HB3' ' B' ' 84' ' ' LEU . 20.0 mm -127.94 162.31 34.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.43 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.069 HG12 ' HB2' ' B' ' 39' ' ' ALA . 4.9 p -160.24 102.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.833 0.349 . . . . 0.0 111.331 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.833 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -136.73 -123.72 2.27 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.102 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -174.61 -46.15 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.787 0.327 . . . . 0.0 111.2 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m-20 -132.25 52.99 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.235 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.933 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -113.84 -154.08 0.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.909 0.385 . . . . 0.0 110.642 179.792 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.713 ' O ' ' HA ' ' A' ' 57' ' ' ILE . . . -154.53 103.84 0.24 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.676 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.736 ' HA ' HG12 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -96.2 137.9 34.6 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.121 0.486 . . . . 0.0 111.486 -179.205 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.941 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -143.83 51.71 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.157 179.6 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.698 HG12 ' HB3' ' A' ' 55' ' ' HIS . 4.5 m -99.6 139.9 20.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.44 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.884 HG21 HG21 ' A' ' 53' ' ' THR . 2.3 t -76.69 138.4 39.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.483 ' CD2' ' CB ' ' B' ' 12' ' ' ASP . 13.9 p-80 -110.81 159.04 18.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.58 176.71 12.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.657 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.651 ' C ' ' HG2' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 66.42 -92.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.976 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.651 ' HG2' ' C ' ' B' ' 70' ' ' THR . 0.9 OUTLIER 164.97 43.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.934 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.564 ' CG ' ' HD3' ' B' ' 87' ' ' LYS . 89.3 m-70 -134.32 46.86 2.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.717 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.711 ' HD1' ' H ' ' B' ' 12' ' ' ASP . 1.0 OUTLIER -126.94 139.93 52.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.525 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.856 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.5 OUTLIER -149.64 129.32 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.956 0.408 . . . . 0.0 111.595 179.819 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.732 ' HD1' HD12 ' B' ' 84' ' ' LEU . 8.5 t80 -114.2 133.54 55.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.986 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.992 ' CD2' HG22 ' B' ' 22' ' ' VAL . 0.2 OUTLIER -165.23 170.02 15.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.344 -179.506 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.693 ' OH ' ' HA ' ' B' ' 80' ' ' GLN . 5.8 t80 -132.67 116.7 16.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.042 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.122 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 3.7 mm? -69.91 167.04 18.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.553 ' O ' ' HG2' ' B' ' 80' ' ' GLN . . . -28.3 -37.23 0.01 OUTLIER Glycine 0 CA--C 1.519 0.296 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.949 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.693 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 5.3 mt-30 -154.42 38.8 0.44 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.727 0.299 . . . . 0.0 111.08 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.833 HG13 ' O ' ' B' ' 59' ' ' GLY . 53.2 t -158.32 167.9 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.111 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.98 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -124.36 160.45 28.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.662 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.98 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.0 OUTLIER -147.5 131.6 9.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 0.0 111.409 -179.583 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.881 ' HB3' ' HB ' ' B' ' 57' ' ' ILE . 4.0 tp -122.73 90.92 3.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.911 HD22 ' HB2' ' B' ' 21' ' ' SER . 0.9 OUTLIER -92.89 140.92 28.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.051 0.453 . . . . 0.0 111.682 -179.216 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.73 ' HZ ' ' HZ ' ' A' ' 86' ' ' PHE . 1.4 p90 -177.09 131.86 0.18 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.749 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.764 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.8 OUTLIER -96.73 158.65 15.33 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.56 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.827 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -103.17 19.22 19.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.235 0.54 . . . . 0.0 110.511 179.799 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.424 -179.986 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.729 ' O ' HD13 ' A' ' 78' ' ' LEU . 15.3 tppt? . . . . . 0 C--O 1.23 0.045 0 CA-C-O 120.645 0.26 . . . . 0.0 110.936 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.028 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 156.21 156.95 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.719 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.49 ' C ' ' H ' ' A' ' 77' ' ' TYR . 58.0 t -123.38 78.85 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.006 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.866 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -48.85 164.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.171 0.51 . . . . 0.0 110.636 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.743 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -163.16 -13.47 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.975 179.733 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.572 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -164.52 89.12 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.32 179.863 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.901 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -126.03 93.43 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.715 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 73' ' ' PHE . 9.1 t70 -85.15 28.98 0.68 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.906 179.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.758 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 34.6 ttp -120.28 157.67 28.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.983 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.79 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 2.3 m -41.32 147.36 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.556 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.9 OUTLIER -54.89 -56.29 21.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.248 -179.69 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.9 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.2 OUTLIER -62.29 -27.59 69.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.944 0.402 . . . . 0.0 110.251 179.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.76 ' HA ' ' OD2' ' A' ' 20' ' ' ASP . 39.7 mmm -71.29 -30.82 66.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.498 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.956 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -79.25 -29.03 42.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.212 179.327 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.9 ' HG2' ' HA ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -77.53 -43.95 30.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.652 179.165 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.76 ' OD2' ' HA ' ' A' ' 17' ' ' MET . 4.9 p30 -70.86 -31.05 67.62 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.492 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.771 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.3 t -65.14 -46.26 81.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.041 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.821 HG22 ' CD2' ' A' ' 76' ' ' PHE . 53.0 t -59.51 -46.87 92.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.088 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.705 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 28.7 mt-10 -56.46 -34.25 66.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.863 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.624 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 49.8 t -71.46 -36.53 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.076 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.765 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -71.78 -30.78 65.91 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.65 ' HA ' HD12 ' A' ' 29' ' ' LEU . 27.8 m -71.92 -37.99 69.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.252 -1.34 . . . . 0.0 109.429 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.817 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -59.69 -44.41 93.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.608 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.979 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -71.91 -25.61 61.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.838 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.711 HD12 ' O ' ' A' ' 25' ' ' ALA . 3.0 mt -72.82 -45.73 56.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.148 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -77.83 -21.88 50.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.817 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 23.9 mmtt -90.04 -26.47 20.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.084 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -166.98 115.22 0.83 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.949 -179.844 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.47 ' OD1' ' O ' ' A' ' 29' ' ' LEU . 28.9 m-20 -81.54 32.79 0.35 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.087 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.816 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 39.7 mm -102.62 101.68 12.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.101 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.515 ' C ' ' O ' ' A' ' 34' ' ' ILE . 1.8 mp0 -24.15 -86.96 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.408 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -40.03 -37.11 0.55 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.754 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.816 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -63.15 -62.19 1.87 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.645 179.811 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.979 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 20.8 mt -47.34 -44.22 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.661 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 1.038 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -58.22 -46.98 84.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.483 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.802 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -57.97 -61.09 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.325 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.843 ' CG ' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -40.98 -58.6 1.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.607 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.991 HG21 HD11 ' A' ' 85' ' ' LEU . 6.1 mt -52.22 -70.94 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.747 ' HD2' ' C ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -38.17 -54.84 1.35 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.031 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.31 -62.74 1.28 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.042 0.448 . . . . 0.0 110.963 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.76 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -52.11 -50.7 61.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.152 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.771 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -57.81 -35.67 71.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.777 ' HA ' ' HD1' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -74.13 -21.16 59.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -122.39 13.38 10.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.331 -179.728 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.76 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -129.37 6.35 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.39 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CD2' ' CD1' ' A' ' 46' ' ' PHE . 97.2 m-85 -148.61 -65.65 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 0.0 111.225 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.453 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 2.6 t-20 163.34 102.83 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.733 ' HA ' ' OD1' ' A' ' 47' ' ' ASP . 45.8 Cg_exo -36.87 154.49 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.665 2.243 . . . . 0.0 112.711 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.814 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 25.9 m -114.44 140.86 48.36 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.047 0.539 . . . . 0.0 110.369 -0.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.777 ' HD1' ' HA ' ' A' ' 47' ' ' ASP . 76.9 m95 -105.62 145.09 31.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.527 0.68 . . . . 0.0 112.422 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.919 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 4.5 m-70 -136.18 101.66 4.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.819 179.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.838 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.76 165.74 14.15 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.796 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.036 HG13 HD23 ' A' ' 84' ' ' LEU . 17.8 mm -133.86 169.66 21.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.22 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.038 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.0 p -166.13 117.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.78 0.324 . . . . 0.0 111.475 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.624 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -151.08 -154.41 6.52 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.06 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.754 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -157.54 32.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.759 0.314 . . . . 0.0 111.388 -179.757 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.754 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER 163.94 29.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.74 179.851 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.833 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.0 OUTLIER -106.6 172.89 6.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.312 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.831 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.2 94.51 0.43 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.921 ' HB2' HD22 ' A' ' 84' ' ' LEU . 69.6 p -82.01 123.61 29.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 111.693 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.927 ' H ' HD13 ' B' ' 57' ' ' ILE . 5.0 t80 -135.11 64.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.16 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.939 HG13 HD11 ' B' ' 57' ' ' ILE . 26.7 m -101.75 148.11 7.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.145 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.774 HG21 HG21 ' B' ' 53' ' ' THR . 5.4 m -91.14 76.05 6.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.509 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 50.8 p-80 -55.1 169.69 0.23 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.463 ' C ' ' OG1' ' A' ' 70' ' ' THR . 0.5 OUTLIER -151.73 169.4 22.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.864 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.463 ' OG1' ' C ' ' A' ' 69' ' ' GLU . 0.3 OUTLIER 78.18 -101.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.052 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.673 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 179.03 28.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 1.092 ' HB2' ' HG3' ' A' ' 87' ' ' LYS . 32.6 m-70 -126.95 52.78 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.886 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 2.9 t80 -126.29 114.99 19.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.157 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.956 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.3 tt -126.4 137.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.895 0.379 . . . . 0.0 111.555 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.572 ' N ' ' O ' ' A' ' 10' ' ' ASN . 38.4 t80 -126.65 116.39 20.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.213 179.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.866 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -139.02 163.29 32.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.004 0.431 . . . . 0.0 111.456 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.627 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 25.8 t80 -121.17 93.41 4.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.499 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.028 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.3 mm? -43.78 172.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.645 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.488 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.82 -39.61 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.584 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.544 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -153.52 21.55 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.956 0.408 . . . . 0.0 110.767 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.79 HG12 ' H ' ' A' ' 82' ' ' ALA . 28.5 t -134.91 177.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.898 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.996 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -137.95 153.33 49.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.805 0.336 . . . . 0.0 110.857 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.996 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.4 OUTLIER -143.49 120.91 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.254 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.036 HD23 HG13 ' A' ' 57' ' ' ILE . 13.2 tp -104.6 90.51 3.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.482 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.991 HD11 HG21 ' A' ' 42' ' ' ILE . 0.3 OUTLIER -95.47 141.92 28.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.648 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.886 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 47.0 p90 177.48 138.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.698 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 1.092 ' HG3' ' HB2' ' A' ' 72' ' ' HIS . 8.0 mtmt -97.44 174.11 6.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.66 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.919 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.357 0 CA-C-O 121.309 0.576 . . . . 0.0 110.534 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.641 HH11 ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.744 0.307 . . . . 0.0 110.72 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.584 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 49.61 30.46 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.07 179.93 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.041 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -124.99 -166.89 1.59 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.145 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.526 ' N ' ' O ' ' B' ' 77' ' ' TYR . 57.8 t -151.18 73.84 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.957 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.955 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -41.04 159.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.093 0.473 . . . . 0.0 110.826 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.761 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 0.2 OUTLIER -155.04 -10.57 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.511 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.573 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.0 OUTLIER -164.6 84.79 0.42 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.34 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.821 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -123.53 88.99 3.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.881 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.611 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 10.8 t0 -87.6 25.35 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.26 0.552 . . . . 0.0 109.959 179.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.896 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.1 OUTLIER -110.96 166.84 10.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.656 -179.723 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.893 ' N ' ' HG2' ' B' ' 13' ' ' MET . 23.2 t -50.07 120.34 4.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.769 0.319 . . . . 0.0 110.731 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.877 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 3.2 mp0 -32.95 -67.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.178 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.459 ' H ' ' HG2' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -46.93 -44.99 20.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.674 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.896 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 31.7 mmm -61.23 -32.08 71.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.93 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -68.35 -43.16 78.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.878 179.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.488 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 2.9 mp0 -69.36 -33.87 73.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -71.4 -33.26 69.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.966 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.813 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.6 OUTLIER -67.94 -40.74 83.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.22 179.435 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.812 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 10.7 t -62.97 -46.12 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.376 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 29.8 mt-10 -62.58 -32.33 73.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.894 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.43 ' SG ' ' HD1' ' B' ' 46' ' ' PHE . 4.9 t -73.45 -36.44 65.9 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.908 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.956 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -69.27 -36.54 77.21 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.505 ' HA ' ' CD1' ' B' ' 29' ' ' LEU . 87.5 m -64.76 -42.79 94.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.618 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.631 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 12.8 mm100 -52.63 -48.67 66.22 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.803 179.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.812 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -59.83 -43.83 94.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.359 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.956 HD12 ' O ' ' B' ' 25' ' ' ALA . 0.9 OUTLIER -59.56 -60.57 3.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.806 179.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -48.57 -33.74 10.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.995 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 0.0 OUTLIER -85.28 -27.73 25.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.39 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.571 ' HE2' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -155.12 150.82 27.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.831 0.348 . . . . 0.0 111.226 -179.202 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.518 ' O ' HD13 ' B' ' 34' ' ' ILE . 35.6 t30 -115.36 47.07 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.95 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.887 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 42.0 mm -126.08 108.56 19.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.864 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.831 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 26.7 mp0 -29.53 -70.85 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.133 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.23 -49.11 61.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.766 0.317 . . . . 0.0 110.741 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.887 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.8 t0 -53.22 -64.27 0.87 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.862 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.842 HG21 ' HG ' ' B' ' 29' ' ' LEU . 11.6 mt -48.9 -43.74 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.691 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.98 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.32 -46.71 76.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.468 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.809 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -61.42 -67.27 0.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.496 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.797 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.7 OUTLIER -34.15 -40.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.538 179.44 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.868 HG21 HD11 ' B' ' 85' ' ' LEU . 33.9 mt -67.33 -50.91 58.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.298 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.712 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 6.1 tttt -55.33 -46.88 76.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.174 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -67.24 -36.83 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.209 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.596 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 8.5 mm-40 -68.45 -44.8 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.905 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.813 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -67.37 -35.27 79.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.678 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.833 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -66.79 -38.77 87.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.221 179.763 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.994 ' HA ' ' HE3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.66 -18.21 25.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.111 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.649 ' HZ2' ' HB3' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -88.75 -29.58 19.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.383 -179.573 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.624 ' HE2' ' CD1' ' B' ' 46' ' ' PHE . 7.0 m-85 -131.74 -57.16 0.99 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.533 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.606 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 27.4 t-20 157.23 119.36 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.11 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.418 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.833 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 20.3 Cg_endo -59.77 170.72 3.31 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.558 2.172 . . . . 0.0 112.255 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.774 HG21 HG21 ' A' ' 67' ' ' THR . 4.4 m -106.85 129.47 54.69 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 123.154 0.582 . . . . 0.0 110.475 0.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.714 ' CD2' ' HD2' ' B' ' 87' ' ' LYS . 58.0 m95 -101.74 116.81 33.54 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.83 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.0 OUTLIER -93.69 100.14 12.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.286 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.74 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.0 OUTLIER -108.54 148.62 30.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.305 0.574 . . . . 0.0 112.457 -178.005 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.978 ' CG1' HD23 ' B' ' 84' ' ' LEU . 19.5 mm -133.6 103.7 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.376 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 0.98 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.4 p -105.87 117.78 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.398 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.852 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -132.43 -104.88 0.94 Allowed Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.177 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.572 ' HD3' ' CG ' ' A' ' 61' ' ' ASN . 1.0 OUTLIER 179.67 -17.71 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.777 0.323 . . . . 0.0 111.131 -179.778 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.469 ' CG ' ' O ' ' B' ' 60' ' ' ARG . 1.2 m120 177.78 41.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.833 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 27.6 p90 -87.61 -167.71 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -131.41 86.6 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.19 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.954 ' HA ' HG23 ' A' ' 57' ' ' ILE . 5.5 p -83.3 119.01 24.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 0.0 111.315 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.802 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 22.9 t80 -127.28 73.35 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.367 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.761 HG21 ' CE1' ' B' ' 86' ' ' PHE . 21.1 m -125.15 156.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.404 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.76 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 20.7 m -84.99 145.99 27.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.756 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.743 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -97.5 173.44 7.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.925 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.722 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 1.3 mm-40 -138.59 -114.92 0.15 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.12 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.582 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -47.29 -103.45 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.066 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.669 ' O ' ' HB2' ' B' ' 72' ' ' HIS . 1.3 mmtt -55.45 0.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.769 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 0.7 OUTLIER 76.77 -89.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.622 -179.859 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.769 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 3.8 p90 163.46 155.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.986 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.93 HD12 ' CA ' ' B' ' 18' ' ' GLN . 1.1 tt -129.6 130.65 67.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.204 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.688 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -113.57 132.32 55.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.056 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.955 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.4 OUTLIER -158.21 152.54 24.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.966 0.412 . . . . 0.0 111.373 -179.45 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.582 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 1.0 OUTLIER -119.74 112.02 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.759 179.7 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.041 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -71.11 170.61 12.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.598 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.507 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.19 -55.93 0.06 OUTLIER Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.94 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -139.54 35.89 2.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.797 0.332 . . . . 0.0 111.035 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.852 HG13 ' O ' ' B' ' 59' ' ' GLY . 92.2 t -151.05 170.19 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 1.014 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -130.18 157.73 41.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.652 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 1.014 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -146.18 133.3 14.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.906 0.384 . . . . 0.0 111.537 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.978 HD23 ' CG1' ' B' ' 57' ' ' ILE . 0.5 OUTLIER -126.87 90.59 3.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.004 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.868 HD11 HG21 ' B' ' 42' ' ' ILE . 0.3 OUTLIER -90.74 130.74 36.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -178.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.761 ' CE1' HG21 ' B' ' 66' ' ' VAL . 1.6 p90 -169.15 120.97 0.75 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.833 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.745 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -87.67 162.99 16.79 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.909 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.83 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 3.0 m -115.87 19.25 15.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.184 0.516 . . . . 0.0 110.89 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.425 -1.208 . . . . 0.0 112.581 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.8 tttp . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.915 0.388 . . . . 0.0 111.121 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 59.41 175.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.34 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.741 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 3.8 t -144.59 73.05 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.546 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.993 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -43.24 130.2 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.883 0.373 . . . . 0.0 110.104 179.578 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.781 ' HE3' ' HB3' ' A' ' 77' ' ' TYR . 2.4 mmtp -120.91 -12.56 8.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.631 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.645 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 2.6 t30 -149.78 -92.1 0.07 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.383 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.883 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 67.21 -163.79 0.22 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.772 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.606 ' N ' ' O ' ' A' ' 73' ' ' PHE . 3.5 t0 169.34 31.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.967 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.891 ' SD ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -106.07 160.34 15.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.146 -179.439 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.573 ' O ' ' N ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -65.78 72.26 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.709 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 3.4 mt-10 32.92 -88.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.213 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 14' ' ' SER . 6.3 pt-20 -31.36 -32.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.108 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.741 ' HG3' ' CB ' ' A' ' 13' ' ' MET . 6.4 tpp -75.02 -45.53 41.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.054 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.759 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -63.22 -29.28 70.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 0.0 110.831 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 74.1 mm-40 -76.92 -45.07 29.22 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.76 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -68.68 -30.9 69.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.803 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.817 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.9 OUTLIER -64.55 -48.16 76.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.678 178.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.8 HG22 ' CD2' ' A' ' 76' ' ' PHE . 55.7 t -55.56 -50.48 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.183 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -52.88 -37.96 61.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.382 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.673 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 76.5 m -68.93 -36.85 78.46 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.147 0.499 . . . . 0.0 110.185 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.747 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.66 -30.06 67.65 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.771 ' HA ' HD12 ' A' ' 29' ' ' LEU . 94.8 m -74.08 -43.29 58.22 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.103 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.827 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -52.66 -44.16 66.0 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.075 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 1.004 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -75.47 -26.58 58.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.205 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.921 HD11 ' HG ' ' A' ' 78' ' ' LEU . 3.6 mt -67.72 -44.93 76.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.374 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -81.0 -28.98 35.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.053 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.562 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.6 OUTLIER -77.43 -31.04 53.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.972 0.415 . . . . 0.0 110.92 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.642 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -160.82 138.86 9.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.511 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.638 ' HA ' HD11 ' A' ' 38' ' ' ILE . 2.6 m120 -100.97 27.84 5.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 0.0 110.627 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 50.4 mm -99.63 91.62 2.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.966 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.744 ' HG2' ' HA2' ' A' ' 59' ' ' GLY . 4.1 mp0 -23.25 -78.93 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.144 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.69 ' HD2' ' CG2' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.42 -42.3 3.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.899 179.725 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.77 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.3 t0 -63.61 -60.73 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.993 0.425 . . . . 0.0 110.583 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 1.004 HG23 ' HB3' ' A' ' 28' ' ' ALA . 41.0 mt -47.97 -40.23 8.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.409 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.999 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -69.31 -41.78 76.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.39 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.75 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -54.39 -57.46 11.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.225 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.623 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -59.17 -57.32 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.98 -179.874 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.747 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 91.8 mt -38.67 -45.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.337 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.729 ' HD3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -68.3 -59.61 3.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.019 -179.77 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.445 ' O ' ' OD2' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -43.76 -51.23 7.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.294 -179.656 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 5.0 tt0 -65.74 -49.31 68.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.991 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.817 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -58.21 -27.98 64.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.744 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -81.01 -34.11 33.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -98.75 5.95 47.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.125 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -126.44 -5.69 6.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.871 179.922 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.76 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 53.8 m-85 -136.82 -63.93 0.6 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.065 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.684 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 7.1 t-20 160.82 110.59 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.38 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.744 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 35.1 Cg_exo -58.38 157.69 25.55 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.433 2.088 . . . . 0.0 112.478 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.918 HG21 HG21 ' B' ' 67' ' ' THR . 11.1 t -108.84 139.0 44.27 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.932 0.493 . . . . 0.0 110.49 -0.101 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.828 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 62.2 m95 -101.9 121.14 41.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.2 0.524 . . . . 0.0 112.193 -178.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.838 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.1 OUTLIER -103.36 93.71 5.11 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.436 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.917 ' O ' HD13 ' A' ' 57' ' ' ILE . 1.6 p -112.78 161.7 16.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.323 0.583 . . . . 0.0 112.489 -178.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.964 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 21.9 mm -134.15 159.01 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.036 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.999 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.3 p -157.59 107.7 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.881 0.372 . . . . 0.0 111.531 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.744 ' HA2' ' HG2' ' A' ' 35' ' ' GLU . . . -143.58 -153.67 5.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.207 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.697 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.68 28.5 0.1 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.628 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.697 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 30.5 t30 167.94 27.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.458 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.973 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -98.54 -157.24 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.978 179.721 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.584 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -154.85 81.17 0.17 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.118 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.799 ' HA ' HG12 ' B' ' 57' ' ' ILE . 74.0 p -66.69 161.2 23.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.012 0.435 . . . . 0.0 111.326 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.764 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 63.3 t80 -167.8 45.32 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.484 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.806 HG21 ' CE1' ' A' ' 86' ' ' PHE . 3.5 m -97.56 152.44 4.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.872 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 1.027 HG22 ' CE1' ' B' ' 55' ' ' HIS . 1.0 OUTLIER -96.96 147.96 23.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.995 -179.778 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.508 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -97.74 169.81 9.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.687 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.646 ' O ' HG23 ' A' ' 70' ' ' THR . 2.6 pt-20 -170.31 69.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.106 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.646 HG23 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 167.24 -110.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.231 179.822 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.706 ' O ' ' HA ' ' A' ' 13' ' ' MET . 20.5 pttm -162.19 6.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.662 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.845 ' HB2' ' HD3' ' A' ' 87' ' ' LYS . 2.1 m-70 -117.35 61.88 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.949 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.724 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.3 t80 -133.69 94.77 3.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.746 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.891 ' HB ' ' SD ' ' A' ' 13' ' ' MET . 2.4 tt -110.18 134.82 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.304 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.645 ' HB3' ' HB3' ' A' ' 10' ' ' ASN . 3.4 t80 -127.15 88.86 2.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.231 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.993 ' HB3' HG13 ' A' ' 8' ' ' ILE . 3.1 p90 -114.86 174.35 6.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.36 -179.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.781 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 24.2 t80 -130.61 105.23 7.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.749 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.3 mm? -55.05 163.99 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.912 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.478 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.27 -47.38 0.18 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.54 20.09 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.709 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.782 HG12 ' H ' ' A' ' 82' ' ' ALA . 28.3 t -139.19 177.4 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.705 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.984 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -138.24 151.15 47.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.55 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.984 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.3 OUTLIER -141.89 122.04 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.957 0.408 . . . . 0.0 111.039 -179.696 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.964 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 4.7 tp -109.82 85.05 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.676 ' HG ' ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -87.84 137.91 31.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.806 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.6 p90 -179.26 132.01 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.373 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.845 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 1.2 mtpm? -102.49 -157.68 0.62 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.79 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.418 0 CA-C-O 121.319 0.58 . . . . 0.0 110.569 179.786 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.435 ' CD ' ' CD ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.847 0.356 . . . . 0.0 110.84 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 49.12 29.45 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.917 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.073 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -123.78 -168.3 1.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.302 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.641 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 40.2 t -153.46 76.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.209 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.771 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.4 mp -35.04 146.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.538 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.912 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 8.8 mmpt? -121.74 -23.39 5.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.376 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.526 HD22 ' HZ ' ' B' ' 73' ' ' PHE . 5.2 t30 -153.11 -86.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.334 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.8 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 59.05 120.49 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.672 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.653 ' HB2' ' CE1' ' B' ' 73' ' ' PHE . 0.5 OUTLIER -117.75 25.12 10.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.261 0.553 . . . . 0.0 110.263 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.836 ' H ' HE22 ' B' ' 18' ' ' GLN . 14.0 ttp -108.45 169.78 8.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.756 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.718 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.8 OUTLIER -52.51 132.88 35.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.798 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.527 ' H ' ' HG3' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -42.73 -65.96 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.902 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -43.86 -34.12 1.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.807 ' SD ' ' HD3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -73.49 -32.72 64.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.942 ' O ' HG23 ' B' ' 22' ' ' VAL . 0.9 OUTLIER -68.48 -37.58 80.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.89 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.643 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -73.62 -38.35 65.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.35 -35.07 71.04 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.657 -0.702 . . . . 0.0 109.759 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.822 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -63.66 -40.82 97.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.844 179.131 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.942 HG23 ' O ' ' B' ' 18' ' ' GLN . 27.5 t -63.57 -44.6 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.304 179.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.643 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 51.5 mt-10 -57.59 -38.73 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.424 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.904 ' HB3' HG23 ' B' ' 42' ' ' ILE . 0.0 OUTLIER -67.82 -36.62 80.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.318 179.53 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.869 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.7 -30.08 65.28 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.424 ' HA ' HD12 ' B' ' 29' ' ' LEU . 11.4 m -73.29 -39.24 65.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.619 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.846 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -57.74 -43.7 85.56 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.404 178.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 1.008 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -68.8 -37.86 79.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.181 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.869 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -63.33 -39.5 94.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.779 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.16 -23.36 38.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.919 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.746 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -86.8 -25.36 24.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.811 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.6 ' CE1' ' HB3' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -157.63 175.1 14.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -133.62 38.4 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.081 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.918 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 5.0 mm -121.4 106.16 17.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.67 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.689 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 3.2 mp0 -29.52 -70.5 0.05 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.937 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.443 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.87 -37.84 14.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.622 179.603 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.918 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 20.0 t0 -66.92 -60.26 2.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 1.059 ' HB ' HG11 ' B' ' 58' ' ' VAL . 4.3 mt -47.71 -47.34 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.769 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.937 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.66 -50.37 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.636 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.764 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -56.44 -62.1 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.56 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.846 ' NE2' ' HB3' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -36.18 -55.02 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.234 179.436 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.904 HG23 ' HB3' ' B' ' 24' ' ' CYS . 16.3 mt -51.39 -69.98 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.089 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.827 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.0 OUTLIER -34.94 -63.34 0.32 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.414 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 0.3 OUTLIER -46.21 -41.63 13.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.114 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.783 ' HB3' ' SG ' ' B' ' 24' ' ' CYS . 2.0 tp10 -69.36 -44.16 72.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.89 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.822 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -65.9 -29.86 70.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.929 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.935 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.63 -40.56 66.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.693 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.528 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.12 -17.97 26.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.052 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.742 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.6 OUTLIER -88.34 -36.42 16.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.763 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.689 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 2.1 m-85 -123.46 -57.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.101 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.689 ' HB3' ' O ' ' B' ' 50' ' ' TYR . 5.9 p-10 154.3 119.62 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.105 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.747 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.935 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 19.2 Cg_endo -59.09 168.49 4.56 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.254 1.969 . . . . 0.0 112.556 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.839 HG21 HG21 ' A' ' 67' ' ' THR . 1.2 t -112.7 119.16 37.13 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 122.726 0.41 . . . . 0.0 111.001 0.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.788 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 26.6 m95 -91.2 113.74 26.08 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.38 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 1.027 ' CE1' HG22 ' A' ' 67' ' ' THR . 3.2 m-70 -72.55 116.13 12.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.827 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 3.6 m -114.95 135.8 53.82 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.278 0.561 . . . . 0.0 112.438 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.799 HG12 ' HA ' ' A' ' 64' ' ' SER . 13.7 mt -139.98 104.92 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.02 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.059 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.8 p -112.52 125.81 69.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.684 -179.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.759 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -146.14 -131.33 2.25 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.682 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -165.69 -0.34 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 120.774 0.321 . . . . 0.0 111.091 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -173.96 34.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.973 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.8 p90 -93.67 163.42 13.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.675 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.726 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -118.15 80.27 0.31 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.815 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.91 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.0 p -77.9 128.02 33.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 111.368 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.75 ' CG ' ' HA ' ' A' ' 40' ' ' ALA . 25.2 t80 -136.85 68.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.348 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.887 HG13 HD11 ' A' ' 57' ' ' ILE . 29.8 m -111.58 151.81 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.107 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.918 HG21 HG21 ' A' ' 53' ' ' THR . 3.7 t -80.97 120.12 24.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.885 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.713 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -60.0 157.27 13.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.582 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 2.3 mt-10 -148.77 151.85 35.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.97 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.782 HG22 ' N ' ' B' ' 71' ' ' LYS . 42.2 m 57.63 -107.64 0.38 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.556 -179.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.807 ' HD3' ' SD ' ' B' ' 17' ' ' MET . 26.7 mttp -72.2 8.29 1.37 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.433 . . . . 0.0 110.375 179.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.772 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 24.8 m-70 79.6 -86.78 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.431 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.772 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 160.91 -175.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.745 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.898 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -158.13 117.58 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.099 179.626 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.82 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 13.2 t80 -108.15 139.21 43.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.605 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.807 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 1.3 p90 -160.32 169.98 22.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.608 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.636 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 23.5 t80 -132.02 113.83 13.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.073 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.4 mm? -70.93 169.43 14.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.781 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.51 -51.82 0.05 OUTLIER Glycine 0 C--N 1.333 0.372 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.845 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.468 ' O ' HG23 ' B' ' 81' ' ' VAL . 3.0 tt0 -143.25 41.61 1.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.81 0.338 . . . . 0.0 110.405 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.759 HG13 ' O ' ' B' ' 59' ' ' GLY . 60.4 t -157.9 169.9 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.189 -179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.653 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -135.12 141.74 46.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.329 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.825 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.2 OUTLIER -128.79 130.53 68.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.085 0.469 . . . . 0.0 111.939 -179.416 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.679 HD23 ' HB ' ' B' ' 57' ' ' ILE . 0.4 OUTLIER -117.33 97.88 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.791 HD11 HG21 ' B' ' 42' ' ' ILE . 1.2 mp -101.09 112.43 24.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.403 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.771 ' CE1' HG21 ' B' ' 66' ' ' VAL . 6.7 p90 -149.71 128.8 12.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.752 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.788 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 42.4 mtpt -93.4 170.12 9.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.296 -179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.756 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -119.2 19.27 12.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.638 179.728 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.459 -1.189 . . . . 0.0 112.544 -179.976 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.915 ' O ' HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.916 0.388 . . . . 0.0 110.859 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.101 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 81.47 152.29 0.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.437 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.629 HG12 ' O ' ' A' ' 7' ' ' VAL . 55.5 t -113.89 74.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.809 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.857 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -39.01 158.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.668 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -151.69 -8.92 0.22 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.764 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.538 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -172.95 92.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.41 180.0 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.825 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -128.76 77.04 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.786 -179.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.57 ' HB3' ' HB3' ' A' ' 72' ' ' HIS . 0.2 OUTLIER -73.72 26.94 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.064 179.104 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.873 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -111.84 171.24 7.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.564 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.873 ' N ' ' HG2' ' A' ' 13' ' ' MET . 18.9 m -56.47 151.56 13.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.767 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.689 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -56.26 -65.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.956 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.743 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -51.39 -25.23 5.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.768 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 68.1 mmm -78.77 -36.23 43.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.061 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 1.049 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -73.34 -36.81 66.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.702 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 37.0 mt-30 -74.74 -36.33 62.64 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.743 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -73.02 -31.72 64.65 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.678 178.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.79 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -64.77 -46.18 83.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.835 179.142 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.915 HG11 ' O ' ' A' ' 5' ' ' LYS . 97.2 t -60.06 -50.66 79.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.405 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.702 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 6.5 mt-10 -52.97 -37.94 61.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.364 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.19 -40.27 93.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.135 0.493 . . . . 0.0 110.056 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.799 ' C ' HD12 ' A' ' 29' ' ' LEU . . . -68.42 -33.39 74.14 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.728 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -71.51 -35.97 70.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.748 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.575 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 1.6 mt-30 -57.4 -42.96 83.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.373 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.998 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -85.93 -24.16 26.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 1.032 HD13 ' HG ' ' A' ' 78' ' ' LEU . 4.7 mt -75.51 -26.35 58.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.728 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.47 -35.27 11.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.607 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.575 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -83.96 -8.59 59.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.321 179.541 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.633 ' CD2' ' HE1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -154.17 -174.57 5.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.791 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -154.57 26.2 0.45 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.569 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.083 ' HB ' ' HB3' ' A' ' 37' ' ' ASP . 11.5 mm -116.01 102.24 13.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.836 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.853 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 4.5 mp0 -25.28 -78.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.183 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.793 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -41.56 -46.24 3.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.703 179.63 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 1.083 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -58.03 -60.04 4.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.779 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.998 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 2.1 mt -48.61 -46.92 15.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.839 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 1.039 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.92 -53.14 61.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.04 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.691 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -42.16 -56.65 2.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.639 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -59.69 -57.04 14.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.907 -179.974 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.752 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 56.5 mt -42.9 -68.13 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.14 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.746 ' HB3' ' CD2' ' B' ' 65' ' ' TYR . 1.5 tmtt? -50.9 -34.85 30.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.94 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -68.94 0.26 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.861 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.593 ' O ' ' N ' ' A' ' 49' ' ' LYS . 39.8 mt-10 -48.23 -54.05 14.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.79 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.8 OUTLIER -45.9 -51.66 12.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.796 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.791 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -64.23 -23.35 67.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.172 -179.837 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.58 11.43 18.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.242 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.593 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -130.4 -8.62 4.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.743 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.665 ' HD1' ' HA ' ' A' ' 46' ' ' PHE . 84.0 m-85 -136.58 -63.5 0.62 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.85 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.558 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 0.5 OUTLIER 157.25 117.98 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.258 -179.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.791 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 20.6 Cg_endo -60.86 167.08 9.23 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.422 2.081 . . . . 0.0 112.42 -179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.779 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.0 OUTLIER -108.86 122.18 46.66 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.039 0.536 . . . . 0.0 110.803 0.046 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.816 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 36.5 m95 -93.48 149.92 20.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 112.034 -179.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.757 ' HD1' ' HB ' ' B' ' 66' ' ' VAL . 5.4 m-70 -127.37 103.49 7.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.418 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.871 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.6 OUTLIER -112.45 132.41 55.07 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.503 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.025 HG21 HG21 ' B' ' 57' ' ' ILE . 29.1 mm -120.24 107.17 20.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.167 178.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.039 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.8 p -107.5 131.21 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.966 0.412 . . . . 0.0 111.609 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.924 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.9 -142.79 3.52 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.817 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.441 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -160.21 3.58 0.08 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.743 0.272 . . . . 0.0 111.679 -179.856 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -177.4 31.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.422 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 1.071 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -92.37 -160.28 0.73 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.964 0.412 . . . . 0.0 110.983 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.736 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -152.72 78.59 0.2 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.034 -0.603 . . . . 0.0 111.941 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 1.078 ' HB2' HD12 ' B' ' 57' ' ' ILE . 25.6 p -72.9 140.27 47.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.972 0.415 . . . . 0.0 111.142 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.818 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 61.2 t80 -152.68 84.17 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.513 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.869 HG21 ' CE1' ' A' ' 86' ' ' PHE . 3.2 m -132.21 168.08 24.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.282 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 1.01 HG21 HG21 ' B' ' 53' ' ' THR . 1.3 t -83.78 -178.48 7.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.616 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.748 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -130.13 153.03 48.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.705 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.957 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 5.3 mm-40 -127.05 -124.61 0.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.272 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.545 ' OG1' ' HE2' ' A' ' 87' ' ' LYS . 11.2 p -31.11 -99.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.779 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.701 ' O ' ' HB2' ' A' ' 13' ' ' MET . 3.0 mmtp -73.18 27.61 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.093 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.772 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 21.1 m-70 62.05 -90.63 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.772 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER 161.66 158.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.503 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 1.049 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -127.77 134.7 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.023 0.44 . . . . 0.0 111.301 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.788 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 1.4 t80 -124.79 138.84 54.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.161 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.861 ' CD2' HG22 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -163.65 164.45 23.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.876 0.37 . . . . 0.0 111.032 -179.692 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.981 ' HD1' ' HB2' ' A' ' 82' ' ' ALA . 74.6 t80 -127.49 94.52 4.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.081 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.101 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.6 mm? -44.05 158.21 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.855 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.455 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.92 -28.91 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.639 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' A' ' 78' ' ' LEU . 13.5 pt20 -153.13 33.41 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.918 0.39 . . . . 0.0 110.946 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.966 HG11 HD21 ' A' ' 29' ' ' LEU . 72.6 t -156.48 170.89 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.981 ' HB2' ' HD1' ' A' ' 77' ' ' TYR . . . -136.56 119.05 15.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.858 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.823 HD11 HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -111.6 129.33 67.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.003 0.43 . . . . 0.0 111.612 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 1.012 HD22 ' HB2' ' A' ' 64' ' ' SER . 0.6 OUTLIER -116.22 92.0 3.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.279 179.647 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.871 HD12 ' HB3' ' A' ' 56' ' ' CYS . 3.1 mp -92.85 135.15 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.003 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.869 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.4 p90 -171.65 121.14 0.49 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.058 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.816 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 1.8 ptmt -104.53 143.16 33.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.785 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.957 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 110.814 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.949 HH21 HD13 ' B' ' 8' ' ' ILE . 7.8 tpt180 . . . . . 0 C--O 1.231 0.086 0 CA-C-O 121.004 0.431 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.671 ' O ' HD13 ' B' ' 78' ' ' LEU . 13.3 tttt -30.62 111.62 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.935 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.98 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 160.74 -172.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.853 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.779 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 53.0 t -150.36 71.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.813 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.961 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.84 143.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.973 -179.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.779 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 8.8 mmpt? -112.17 -28.41 7.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.923 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.618 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -157.5 -91.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.241 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.806 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 78.44 97.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.066 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.2 t0 -90.47 29.84 1.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.18 0.514 . . . . 0.0 109.975 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.921 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.0 OUTLIER -116.25 153.26 32.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.606 -179.66 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.755 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -37.0 154.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -61.79 -68.22 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.794 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -48.3 -24.06 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.666 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.921 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -76.88 -42.56 39.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.851 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 1.1 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -65.32 -29.15 69.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.035 0.445 . . . . 0.0 110.252 179.525 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.505 ' NE2' ' HD3' ' B' ' 4' ' ' ARG . 4.3 mm100 -77.59 -43.26 32.23 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.28 0.562 . . . . 0.0 109.598 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.617 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.9 OUTLIER -69.78 -27.69 65.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.682 178.895 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.804 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 2.5 t -68.04 -49.56 60.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.928 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.908 HG22 ' CD2' ' B' ' 76' ' ' PHE . 76.7 t -55.77 -46.54 79.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.156 179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.53 -40.26 86.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.023 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.626 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 1.3 m -66.68 -34.28 77.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.759 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.829 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.45 -32.26 68.11 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.522 ' HA ' HD12 ' B' ' 29' ' ' LEU . 12.4 m -70.94 -41.25 71.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.142 -1.39 . . . . 0.0 109.858 178.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.797 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 3.3 mm100 -55.83 -46.9 78.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.752 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 1.002 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -65.58 -34.39 78.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.403 179.239 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.829 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -66.21 -50.18 64.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.16 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . 0.683 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -66.7 -27.59 67.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.013 -179.811 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.797 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 28.0 mmtp -85.68 -26.81 25.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.89 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.573 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -157.33 151.78 25.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.729 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.679 ' C ' HD13 ' B' ' 34' ' ' ILE . 1.5 p30 -113.28 36.37 3.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.903 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.83 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.6 mm -118.98 108.72 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.932 ' HA ' HD12 ' B' ' 38' ' ' ILE . 54.7 mm-40 -29.7 -71.08 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.024 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.465 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.1 OUTLIER -46.32 -45.99 17.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.895 0.379 . . . . 0.0 110.646 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.83 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 15.0 t0 -58.92 -61.28 2.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.85 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 1.002 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 2.1 mt -43.93 -47.75 2.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.816 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 1.042 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -57.14 -59.43 5.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.529 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -45.63 -61.57 1.65 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.779 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.9 OUTLIER -41.62 -49.04 4.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.264 179.387 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.666 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 18.8 mt -61.51 -68.64 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.815 ' HE2' ' HB3' ' B' ' 47' ' ' ASP . 1.4 tptm -39.62 -27.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.689 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -75.98 -60.34 2.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.0 0.429 . . . . 0.0 110.858 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.736 ' HG2' ' O ' ' B' ' 41' ' ' HIS . 0.4 OUTLIER -60.56 -25.88 66.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.04 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.804 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -76.86 -48.04 19.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.419 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.815 ' HB3' ' HE2' ' B' ' 43' ' ' LYS . 3.2 p30 -64.21 -27.17 68.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.274 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.439 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -90.03 -41.61 11.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.029 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.68 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -79.04 -20.02 49.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.048 -179.632 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.685 ' CD1' ' HA ' ' B' ' 46' ' ' PHE . 8.9 m-85 -128.66 -70.03 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.452 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.834 HD22 ' HD2' ' B' ' 52' ' ' PRO . 1.3 t-20 157.38 117.58 0.0 OUTLIER Pre-proline 0 CA--C 1.529 0.163 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.479 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.834 ' HD2' HD22 ' B' ' 51' ' ' ASN . 30.1 Cg_endo -63.01 170.1 8.03 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.369 2.046 . . . . 0.0 112.526 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 1.01 HG21 HG21 ' A' ' 67' ' ' THR . 0.6 OUTLIER -103.54 132.49 49.74 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 122.822 0.449 . . . . 0.0 110.544 0.041 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.774 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 46.4 m95 -101.62 104.66 15.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.574 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.849 ' HE1' HG22 ' A' ' 67' ' ' THR . 37.1 m-70 -69.42 90.71 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 23.8 p -105.06 123.73 48.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.059 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 1.078 HD12 ' HB2' ' A' ' 64' ' ' SER . 19.0 mm -118.08 108.28 24.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.088 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.042 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.4 p -111.07 120.91 62.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.868 0.366 . . . . 0.0 111.369 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.639 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.77 -136.09 3.47 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.063 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.477 ' O ' ' OD1' ' B' ' 61' ' ' ASN . 0.4 OUTLIER -162.67 5.61 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 120.873 0.368 . . . . 0.0 111.13 -179.568 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.477 ' OD1' ' O ' ' B' ' 60' ' ' ARG . 0.8 OUTLIER 171.18 31.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 1.071 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -89.29 -170.4 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.024 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.853 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -139.46 76.92 0.33 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.081 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.979 ' CB ' HD12 ' A' ' 57' ' ' ILE . 9.6 p -69.66 138.12 52.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.012 0.434 . . . . 0.0 111.191 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.763 ' H ' HD13 ' A' ' 57' ' ' ILE . 68.3 t80 -146.24 88.55 1.8 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.828 HG21 ' CE1' ' B' ' 86' ' ' PHE . 10.2 m -125.74 145.68 32.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.348 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.779 HG21 ' CG2' ' A' ' 53' ' ' THR . 0.0 OUTLIER -80.13 70.05 6.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.632 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.548 ' CD2' ' HB2' ' B' ' 12' ' ' ASP . 1.6 p-80 -51.24 160.91 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' B' ' 71' ' ' LYS . 0.8 OUTLIER -156.84 -144.75 0.14 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.768 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.528 ' OG1' ' N ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 39.99 -90.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.729 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.5 OUTLIER 163.21 21.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 179.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.495 ' HB3' ' CZ3' ' B' ' 54' ' ' TRP . 39.6 m80 -115.96 52.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.765 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.867 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.9 t80 -127.34 123.92 37.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 1.1 HG13 ' HB3' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -135.42 117.36 20.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.537 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.566 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -103.35 134.74 46.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.007 178.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.961 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.5 OUTLIER -162.68 169.15 20.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.902 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.568 ' O ' ' N ' ' B' ' 7' ' ' VAL . 49.4 t80 -135.38 115.77 13.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.756 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 0.98 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -68.77 169.99 10.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.763 -179.769 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.427 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -35.09 -35.46 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.742 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' B' ' 78' ' ' LEU . 1.4 pt20 -154.38 33.8 0.42 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.823 0.344 . . . . 0.0 111.134 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.63 HG12 ' N ' ' B' ' 82' ' ' ALA . 55.3 t -152.83 168.22 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.613 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.918 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -131.62 152.29 50.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.819 0.343 . . . . 0.0 111.111 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.918 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -141.95 123.77 13.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.393 -179.628 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.924 HD23 HG12 ' B' ' 57' ' ' ILE . 0.4 OUTLIER -117.89 90.2 3.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.404 179.756 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.78 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -94.64 130.78 40.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.618 -179.442 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.867 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 16.8 p90 -169.01 132.53 1.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.476 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.774 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 1.2 mtpp -108.16 170.47 7.98 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.733 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.449 ' OG ' ' CB ' ' A' ' 88' ' ' SER . 0.2 OUTLIER -122.01 19.89 10.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.306 0.574 . . . . 0.0 110.998 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.426 -1.208 . . . . 0.0 112.598 -179.919 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.592 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 22.3 tptm . . . . . 0 C--O 1.231 0.122 0 CA-C-O 120.865 0.364 . . . . 0.0 110.791 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.976 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.28 173.7 9.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.406 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.742 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 38.5 t -132.7 81.32 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.674 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.873 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -50.32 150.62 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.978 0.418 . . . . 0.0 110.505 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.762 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -159.42 1.11 0.08 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.787 -179.771 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.821 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 0.1 OUTLIER -160.25 77.55 0.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.553 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.683 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.06 174.35 6.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.232 0.539 . . . . 0.0 111.879 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.678 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -174.03 28.51 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.398 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.86 ' H ' HE22 ' A' ' 18' ' ' GLN . 16.0 ttp -124.45 171.15 10.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.688 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.706 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.4 OUTLIER -53.57 138.24 34.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.656 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -43.95 -67.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.52 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -48.15 -34.13 9.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.94 -179.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.744 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 47.2 mmm -68.92 -29.83 68.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.862 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.981 ' HA ' HD12 ' A' ' 74' ' ' ILE . 1.6 mm100 -74.21 -39.09 63.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.654 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.739 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 6.9 mt-30 -74.83 -34.23 62.3 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.3 OUTLIER -73.53 -36.86 65.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.642 178.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.971 ' HB2' HD22 ' A' ' 85' ' ' LEU . 56.6 p -62.91 -47.38 83.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.835 178.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.972 HG23 ' O ' ' A' ' 18' ' ' GLN . 26.3 t -57.64 -49.97 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.739 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 40.9 mt-10 -55.14 -38.57 68.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.213 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.69 -37.39 84.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.187 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.717 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -70.93 -27.83 64.05 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 178.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 5.3 m -73.85 -39.99 63.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.355 178.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.59 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -56.51 -45.36 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.629 178.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.878 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -75.3 -23.38 57.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.752 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 1.062 HD21 HG11 ' A' ' 81' ' ' VAL . 7.0 mt -73.94 -34.02 64.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -94.17 -21.75 18.88 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.533 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.614 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 41.0 mmtm -90.1 -13.16 36.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.676 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.681 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -152.26 -142.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.61 ' HA ' HD11 ' A' ' 38' ' ' ILE . 0.6 OUTLIER 159.88 34.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.501 179.796 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.949 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 33.2 mm -113.97 39.21 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.184 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.787 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.6 mp0 36.69 -87.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.58 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.677 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.06 -43.42 3.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.378 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.949 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.9 t70 -60.45 -57.62 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.335 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.878 HG23 ' HB3' ' A' ' 28' ' ' ALA . 3.2 mt -48.3 -55.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.856 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -53.1 -46.65 68.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.88 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.717 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -52.03 -54.56 28.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.054 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.552 ' HD1' ' HB1' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -60.82 -55.21 35.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.737 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.748 HD11 HG22 ' A' ' 38' ' ' ILE . 76.3 mt -44.31 -56.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.137 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.84 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.2 OUTLIER -53.42 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.754 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.579 ' HA ' ' OD2' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -35.61 -53.81 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.565 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.2 mm-40 -51.37 -58.94 4.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.78 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.743 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 3.0 m-85 -52.35 -48.6 65.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.786 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.801 ' HB2' ' HB3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -61.54 -19.25 61.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.653 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.34 12.3 10.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.0 OUTLIER -124.44 -16.87 6.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.096 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.701 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 27.1 m-85 -140.1 -55.36 0.54 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.801 0.334 . . . . 0.0 111.238 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.701 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 3.5 t30 160.1 119.77 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.169 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.314 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.801 ' HB3' ' HB2' ' A' ' 47' ' ' ASP . 39.4 Cg_endo -67.02 166.87 21.47 Favored 'Trans proline' 0 CA--C 1.532 0.399 0 C-N-CA 122.464 2.109 . . . . 0.0 112.344 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.811 HG22 ' CE1' ' A' ' 55' ' ' HIS . 3.7 m -106.64 128.28 54.04 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 122.817 0.447 . . . . 0.0 110.77 0.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.796 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.7 m95 -94.64 123.38 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.856 -179.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.892 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.0 OUTLIER -106.9 97.69 7.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.588 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.882 ' HB2' HD12 ' A' ' 85' ' ' LEU . 27.7 p -117.5 162.37 18.09 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.93 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 16.5 mm -129.47 168.48 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.01 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.9 p -165.04 110.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.899 0.38 . . . . 0.0 111.479 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.792 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -146.48 -128.14 1.9 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.205 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.564 ' HG3' ' NH1' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -167.14 -37.67 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.785 0.326 . . . . 0.0 111.121 -179.755 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -140.16 52.61 1.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.247 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 1.053 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.4 OUTLIER -110.11 168.46 9.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.374 . . . . 0.0 110.758 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.901 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -115.1 81.31 0.3 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.959 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.927 ' HA ' HG12 ' B' ' 57' ' ' ILE . 1.0 OUTLIER -76.06 137.95 40.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.968 0.414 . . . . 0.0 111.472 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.742 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 9.1 t80 -151.16 65.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.42 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.678 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 28.5 m -112.78 161.74 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.187 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.767 HG23 ' N ' ' A' ' 68' ' ' HIS . 2.8 t -81.65 -149.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.952 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.767 ' N ' HG23 ' A' ' 67' ' ' THR . 5.7 p-80 179.59 161.2 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.711 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -161.64 165.07 28.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.041 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.456 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 9.1 m 68.72 -93.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.126 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER 168.3 67.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.858 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 95.9 m-70 -154.73 16.73 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.988 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 8.8 t80 -99.4 101.0 12.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.37 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.981 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -123.56 118.87 55.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.958 0.408 . . . . 0.0 111.595 -179.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.821 ' HB3' ' HB3' ' A' ' 10' ' ' ASN . 75.9 t80 -112.76 135.03 53.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.111 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.873 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -150.13 176.55 10.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.877 0.37 . . . . 0.0 111.203 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.778 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 7.2 t80 -132.4 99.45 4.68 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.19 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.976 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.9 mm? -65.24 -174.83 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.329 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.46 ' O ' ' CB ' ' A' ' 80' ' ' GLN . . . -60.18 85.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.062 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.778 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 5.7 tt0 82.68 12.31 0.52 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.807 0.337 . . . . 0.0 110.739 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 1.062 HG11 HD21 ' A' ' 29' ' ' LEU . 68.5 t -136.09 173.58 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.853 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.807 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -148.99 154.67 39.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.858 0.361 . . . . 0.0 111.142 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.807 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.4 OUTLIER -139.95 116.08 8.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.037 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.93 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 12.6 tp -97.98 86.52 3.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.785 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.971 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -90.48 139.24 30.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.051 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.988 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.0 OUTLIER -172.53 121.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.355 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.857 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.8 OUTLIER -94.21 118.99 32.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.792 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.864 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-O 121.311 0.576 . . . . 0.0 110.784 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.674 ' HD2' ' OE1' ' B' ' 19' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.772 0.32 . . . . 0.0 110.765 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -89.99 36.08 0.86 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.073 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.071 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -110.52 -155.33 0.56 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.055 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.563 ' N ' ' O ' ' B' ' 77' ' ' TYR . 6.8 t -158.36 67.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.134 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.896 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.1 mp -35.66 142.84 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 110.153 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 1.008 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 5.2 mmpt? -120.86 -22.41 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.598 ' C ' HD22 ' B' ' 10' ' ' ASN . 0.2 OUTLIER -150.21 -104.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.308 179.758 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.755 ' CB ' ' HA ' ' B' ' 74' ' ' ILE . . . 69.25 145.34 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.176 0.512 . . . . 0.0 111.743 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.565 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -145.17 25.49 1.39 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.647 179.216 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.648 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 20.1 ttp -102.04 166.47 10.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.989 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.733 ' HB2' ' HG3' ' B' ' 17' ' ' MET . 2.2 m -47.68 143.52 3.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.814 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 3.4 pt-20 -49.84 -69.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.864 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.761 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -47.34 -21.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.763 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.733 ' HG3' ' HB2' ' B' ' 14' ' ' SER . 0.0 OUTLIER -82.39 -37.73 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.017 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 0.99 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.26 -34.72 68.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.659 179.869 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.674 ' OE1' ' HD2' ' B' ' 4' ' ' ARG . 37.7 mt-30 -77.86 -40.42 40.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.927 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.761 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -69.15 -33.44 73.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.638 179.161 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.869 ' HB2' HD22 ' B' ' 85' ' ' LEU . 0.6 OUTLIER -65.48 -49.28 69.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.154 179.286 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.984 HG22 ' CD2' ' B' ' 76' ' ' PHE . 84.1 t -59.94 -37.11 70.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.162 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 62.2 mt-10 -63.86 -35.05 79.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.344 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.502 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 3.5 t -72.82 -34.61 66.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 109.798 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.741 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -72.63 -35.04 67.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.924 ' HA ' HD12 ' B' ' 29' ' ' LEU . 51.7 m -69.83 -43.89 71.05 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.622 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.813 ' HG3' ' N ' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -52.73 -46.84 67.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.526 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.813 ' N ' ' HG3' ' B' ' 27' ' ' GLN . . . -71.28 -24.14 62.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.721 178.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.924 HD12 ' HA ' ' B' ' 26' ' ' THR . 3.5 mt -71.34 -36.82 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.543 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -86.74 -28.83 22.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.625 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.779 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 44.7 mmtm -84.25 -27.61 27.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.766 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -148.87 164.49 34.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.662 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.49 ' C ' HD13 ' B' ' 34' ' ' ILE . 9.7 m120 -129.65 31.25 4.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 1.053 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.2 mm -113.7 107.1 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.901 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 13.9 mp0 -31.15 -67.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.545 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -48.57 -60.69 2.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.789 179.594 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 1.053 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.2 m-20 -45.29 -65.1 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.664 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.829 ' HB ' HG11 ' B' ' 58' ' ' VAL . 9.9 mt -41.91 -46.74 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.127 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 1.047 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -64.88 -42.46 94.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.984 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.742 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -57.85 -59.44 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.156 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.697 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -53.53 -55.06 28.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.661 179.985 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.81 HD11 HG22 ' B' ' 38' ' ' ILE . 37.7 mt -45.5 -69.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.698 ' HD2' ' HE2' ' A' ' 65' ' ' TYR . 4.4 tmtt? -45.21 -36.45 3.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.898 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.511 ' O ' ' HE2' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -65.94 -50.01 65.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.977 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.769 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.8 OUTLIER -64.86 -35.88 82.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.912 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.798 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -68.61 -40.52 80.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.029 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.78 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.43 -39.07 85.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.899 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -32.37 34.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.769 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.82 -13.28 39.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.776 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.722 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 98.6 m-85 -123.58 -73.23 0.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.48 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.722 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.6 t-20 159.21 113.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.172 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.78 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 78.5 Cg_exo -42.13 151.06 0.21 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.208 1.939 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.759 HG23 ' CE1' ' B' ' 55' ' ' HIS . 2.8 t -122.41 131.84 54.08 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 122.895 0.478 . . . . 0.0 110.51 0.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 1.019 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 53.3 m95 -96.16 126.01 41.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.716 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.759 ' CE1' HG23 ' B' ' 53' ' ' THR . 0.0 OUTLIER -98.13 94.08 6.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.092 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 1.039 ' HB3' HD12 ' B' ' 85' ' ' LEU . 1.8 m -112.61 169.68 8.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.437 0.637 . . . . 0.0 112.015 -177.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.935 HD12 HD23 ' B' ' 84' ' ' LEU . 32.8 mt -158.34 162.19 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.346 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.047 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.2 p -159.54 114.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.003 0.43 . . . . 0.0 111.488 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.816 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -143.2 -133.92 2.82 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.942 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.404 ' H ' ' H ' ' B' ' 61' ' ' ASN . 5.3 ptm180 -172.88 10.03 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.778 0.323 . . . . 0.0 111.168 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.44 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -174.62 32.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.216 -179.908 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 1.053 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 8.8 p90 -102.81 168.34 9.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.05 0.452 . . . . 0.0 111.142 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -121.79 81.84 0.35 Allowed Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.064 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.923 ' HA ' HG23 ' A' ' 57' ' ' ILE . 8.7 p -75.88 123.27 25.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.959 0.409 . . . . 0.0 111.324 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.84 ' HE2' ' HD2' ' A' ' 43' ' ' LYS . 10.8 t80 -134.85 68.88 1.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.507 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.904 HG21 ' CE1' ' B' ' 86' ' ' PHE . 4.6 m -114.88 150.99 16.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.457 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 16.3 m -87.37 95.99 10.2 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.857 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.807 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 10.6 p-80 -61.87 159.08 14.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.573 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -152.65 -171.6 3.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.614 179.98 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.593 HG22 ' HG2' ' B' ' 71' ' ' LYS . 29.8 m 51.68 -119.54 1.47 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.413 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.593 ' HG2' HG22 ' B' ' 70' ' ' THR . 55.5 mmtt -72.95 31.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 0.0 110.202 179.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.807 ' O ' ' HB2' ' B' ' 68' ' ' HIS . 63.2 m-70 61.49 -93.67 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.496 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.793 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 159.4 -161.06 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.99 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.5 OUTLIER -165.3 111.66 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.049 179.24 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.549 ' HE1' ' HZ ' ' B' ' 62' ' ' PHE . 9.6 t80 -110.12 98.27 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.984 ' CD2' HG22 ' B' ' 22' ' ' VAL . 3.6 p90 -118.58 169.67 9.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.67 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 31.2 t80 -132.27 113.21 12.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.522 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.071 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -70.39 169.87 13.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.73 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.516 ' C ' ' HG2' ' B' ' 80' ' ' GLN . . . -24.76 -47.63 0.02 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.117 -0.564 . . . . 0.0 113.218 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.516 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -145.71 29.83 1.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.644 0.259 . . . . 0.0 111.142 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.816 HG13 ' O ' ' B' ' 59' ' ' GLY . 97.1 t -143.61 170.11 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.285 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.771 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -137.1 126.09 24.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.552 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.658 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.3 OUTLIER -114.66 124.05 70.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.134 0.493 . . . . 0.0 111.832 -179.399 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.935 HD23 HD12 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -106.85 93.96 4.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.039 179.655 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 1.039 HD12 ' HB3' ' B' ' 56' ' ' CYS . 0.5 OUTLIER -100.43 122.86 43.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.276 -179.414 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.904 ' CE1' HG21 ' B' ' 66' ' ' VAL . 18.3 p90 -163.83 115.06 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.319 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 1.019 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 5.6 ptmt -105.02 158.32 16.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.684 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.573 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.6 OUTLIER -95.52 19.45 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.229 0.538 . . . . 0.0 110.869 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . 0.745 ' HA2' ' CE ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.47 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.62 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.862 0.363 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.045 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -141.67 173.34 11.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.244 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.47 ' HB ' ' HB3' ' A' ' 77' ' ' TYR . 39.0 t -139.05 75.78 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.033 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.828 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -38.89 160.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.13 0.49 . . . . 0.0 110.637 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.734 ' HD3' ' O ' ' A' ' 8' ' ' ILE . 2.8 mmtp -159.44 -6.96 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.63 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.477 ' CG ' ' HZ ' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -167.51 71.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.393 179.984 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.877 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -117.5 92.36 3.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.664 -179.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.811 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 53.7 m-20 -90.53 26.41 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.154 0.502 . . . . 0.0 110.246 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.775 ' HG3' ' H ' ' A' ' 14' ' ' SER . 16.0 ttp -109.85 173.33 6.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.775 ' H ' ' HG3' ' A' ' 13' ' ' MET . 1.2 t -57.91 140.85 51.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.86 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.571 ' HA ' ' CG ' ' A' ' 18' ' ' GLN . 11.9 mt-10 -47.98 -62.91 1.23 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.967 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 1.1 mt-10 -51.68 -31.62 26.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.566 ' SD ' ' HD3' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -72.57 -45.59 58.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 1.007 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -62.4 -36.86 83.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.943 179.957 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.549 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 10.2 mt-30 -73.57 -35.17 65.43 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.483 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -74.05 -27.74 61.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.699 178.917 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.829 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.4 t -71.22 -41.03 70.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.06 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.958 HG22 ' CD2' ' A' ' 76' ' ' PHE . 94.7 t -65.58 -46.67 88.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.613 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.719 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 58.2 mt-10 -57.97 -41.7 83.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.114 179.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 20.3 m -64.35 -37.04 86.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.758 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.891 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -69.99 -32.56 70.82 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 22' ' ' VAL . 1.6 m -69.27 -38.82 78.56 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.47 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.775 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 57.5 mt-30 -59.22 -41.01 87.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.943 179.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.99 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -73.21 -31.72 64.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.132 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.891 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.3 mt -72.13 -35.68 69.18 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.327 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -93.17 -11.78 31.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.352 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.775 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 8.4 mttm -96.43 -19.82 18.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.723 0.297 . . . . 0.0 111.216 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.594 ' HE1' ' ND1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -151.46 -62.77 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.031 179.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.935 ' HA ' HD11 ' A' ' 38' ' ' ILE . 5.7 t-20 74.83 61.12 0.07 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.75 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.057 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 44.3 mm -141.21 57.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.011 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.617 ' O ' HG13 ' A' ' 58' ' ' VAL . 1.5 mp0 31.87 -91.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.974 0.416 . . . . 0.0 110.266 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.673 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -44.02 -54.03 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.214 179.105 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 1.057 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -52.26 -58.29 7.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.978 179.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.99 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 24.5 mt -48.22 -43.42 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.939 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.896 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -62.22 -49.62 75.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.765 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.815 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -53.26 -45.74 68.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.776 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.827 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -57.2 -58.44 8.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.622 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.917 HG21 HD11 ' A' ' 85' ' ' LEU . 8.0 mt -50.42 -74.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.367 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.721 ' HD3' ' CD2' ' B' ' 65' ' ' TYR . 7.6 tttt -39.11 -40.62 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.799 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.587 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.21 -62.36 1.7 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.038 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -60.48 -58.95 6.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.871 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.829 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.9 OUTLIER -42.02 -38.19 1.57 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.769 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -69.35 -43.74 73.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.837 -179.855 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.998 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -95.94 9.78 39.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.316 -179.844 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -129.96 -5.54 4.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.119 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.793 ' HD1' ' HA ' ' A' ' 46' ' ' PHE . 75.9 m-85 -138.39 -61.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.224 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.5 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.6 OUTLIER 158.8 109.62 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.223 -179.708 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.769 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 51.7 Cg_exo -54.23 148.81 39.26 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.39 2.06 . . . . 0.0 112.734 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.892 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.2 OUTLIER -117.42 144.12 45.31 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.882 0.473 . . . . 0.0 110.731 -0.021 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.651 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 70.7 m95 -101.19 114.88 29.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.499 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.807 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -86.3 92.31 8.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 1.055 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.4 OUTLIER -106.81 144.36 33.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.233 0.539 . . . . 0.0 112.293 -178.412 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.046 HD11 HG13 ' B' ' 66' ' ' VAL . 14.5 mm -132.81 107.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.341 179.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.896 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.1 p -107.47 129.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.954 0.407 . . . . 0.0 111.479 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.764 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.98 -127.07 1.06 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.057 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.508 ' O ' ' HE2' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -160.56 -54.48 0.05 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 120.746 0.307 . . . . 0.0 111.23 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.814 ' HB3' ' CZ ' ' B' ' 60' ' ' ARG . 0.1 OUTLIER -130.94 67.54 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.084 -179.792 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.814 ' HE2' ' HB3' ' A' ' 64' ' ' SER . 1.4 p90 -122.57 -166.02 1.37 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.872 0.368 . . . . 0.0 110.861 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.601 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -138.07 75.51 0.38 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.029 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.814 ' HA ' HG23 ' B' ' 57' ' ' ILE . 73.8 p -67.86 133.71 49.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.828 0.347 . . . . 0.0 111.177 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.877 ' HD2' ' HG2' ' B' ' 43' ' ' LYS . 16.1 t80 -151.42 79.54 1.29 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.897 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.955 HG21 ' CD1' ' A' ' 86' ' ' PHE . 21.2 m -110.09 176.67 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.039 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.786 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 55.1 m -107.01 108.97 20.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.83 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.625 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -57.89 157.39 7.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 179.938 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.725 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 9.9 mm-40 -136.96 -125.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.923 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.482 ' O ' ' O ' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -30.18 -97.61 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.225 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.566 ' HD3' ' SD ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -78.94 46.55 0.7 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.521 -179.972 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.811 ' ND1' ' HB3' ' A' ' 12' ' ' ASP . 18.8 m170 47.48 -90.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.623 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.749 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 4.7 p90 163.13 -160.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.594 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 1.007 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -168.08 129.8 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.581 179.743 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 15.4 t80 -123.19 136.14 54.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.612 178.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.958 ' CD2' HG22 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -154.57 168.87 25.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.996 0.427 . . . . 0.0 111.193 -179.314 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.704 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 11.7 t80 -127.1 99.09 5.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.187 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.045 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -65.91 -175.06 0.27 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 179.76 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.451 ' O ' ' HB3' ' A' ' 80' ' ' GLN . . . -58.11 86.78 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.978 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.451 ' HB3' ' O ' ' A' ' 79' ' ' GLY . 48.0 tt0 78.01 23.25 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 0.0 110.195 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.764 HG13 ' O ' ' A' ' 59' ' ' GLY . 45.5 t -141.97 167.13 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.782 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.806 ' HB3' ' HE1' ' A' ' 62' ' ' PHE . . . -146.43 118.58 8.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.795 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -105.11 139.99 24.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.973 0.416 . . . . 0.0 111.609 -179.53 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.974 HD23 HG12 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -124.7 94.53 4.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.378 179.644 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 1.055 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -99.6 129.14 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.556 -179.318 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.955 ' CD1' HG21 ' A' ' 66' ' ' VAL . 1.4 p90 -166.32 119.37 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.909 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.651 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -105.82 151.79 24.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.067 -179.949 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.725 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-O 121.175 0.512 . . . . 0.0 110.809 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.578 ' NH1' ' HG3' ' B' ' 4' ' ' ARG . 3.2 mmm-85 . . . . . 0 C--O 1.232 0.159 0 CA-C-O 120.825 0.345 . . . . 0.0 110.937 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.662 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.0 OUTLIER 77.62 98.27 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.689 -179.869 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 1.051 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.03 -168.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.767 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.691 ' CG1' ' HE2' ' B' ' 9' ' ' LYS . 99.5 t -152.78 75.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.252 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.98 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -51.01 145.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.114 0.483 . . . . 0.0 110.419 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.691 ' HE2' ' CG1' ' B' ' 7' ' ' VAL . 0.5 OUTLIER -142.16 -10.3 0.87 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.156 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.551 ' CG ' ' HZ ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -162.54 72.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.564 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.788 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -113.05 90.53 3.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.543 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.685 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 21.5 m-20 -90.92 26.96 1.94 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.1 0.476 . . . . 0.0 110.334 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.741 ' HG3' ' H ' ' B' ' 14' ' ' SER . 13.7 ttp -111.2 170.63 7.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.89 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.851 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 40.8 t -53.84 128.57 30.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.664 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.716 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 20.1 mt-10 -37.63 -68.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.896 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -46.51 -27.7 1.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.827 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.851 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -73.88 -45.77 48.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.976 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 1.024 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -62.18 -30.03 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . 0.551 ' HG2' ' HD3' ' B' ' 4' ' ' ARG . 74.5 mt-30 -77.84 -41.59 36.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.052 0.453 . . . . 0.0 109.908 179.504 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.469 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -69.24 -29.26 67.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.712 179.177 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.845 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 13.9 t -68.72 -48.7 63.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.184 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.888 HG22 ' CD2' ' B' ' 76' ' ' PHE . 74.2 t -57.58 -43.8 83.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.404 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.5 -35.35 77.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.806 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 90.9 m -71.35 -35.22 71.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.738 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.765 ' HA ' HG12 ' B' ' 42' ' ' ILE . . . -71.61 -32.25 67.8 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.519 ' HA ' HD12 ' B' ' 29' ' ' LEU . 90.9 m -72.1 -42.23 66.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.372 -1.286 . . . . 0.0 109.663 178.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.584 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -52.72 -46.42 67.38 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.241 178.811 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.908 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -64.76 -38.18 90.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.887 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.714 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -64.07 -33.23 75.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.617 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -78.71 -32.09 46.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.764 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 5.8 mmtt -85.54 -19.91 30.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.654 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.537 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -165.98 164.37 18.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.776 179.677 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -124.55 27.99 6.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.756 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.848 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.7 mm -104.5 107.86 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.938 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.781 ' HA ' HD12 ' B' ' 38' ' ' ILE . 0.9 OUTLIER -30.31 -70.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.501 ' H ' ' HG2' ' B' ' 36' ' ' LYS . 1.8 mmmt -44.71 -49.26 10.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.848 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.4 OUTLIER -55.89 -61.02 2.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 179.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 1.059 ' HB ' HG11 ' B' ' 58' ' ' VAL . 2.5 mt -46.22 -56.86 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.931 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 0.88 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -44.83 -46.69 10.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.606 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.871 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -65.24 -65.49 0.67 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.436 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.624 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.8 t60 -37.09 -34.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.76 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 1.019 HG21 HD11 ' B' ' 85' ' ' LEU . 39.5 mt -73.46 -66.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.938 179.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.877 ' HG2' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -48.5 -24.02 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.503 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.519 ' N ' ' HD3' ' B' ' 43' ' ' LYS . 2.7 tttm -74.89 -58.38 3.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.793 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.785 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 4.1 mt-10 -62.84 -30.67 71.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.68 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.845 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -69.88 -43.29 72.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.836 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.806 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -63.22 -36.99 85.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.129 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -89.94 -24.07 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.714 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.785 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.46 -13.19 35.32 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.402 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.608 ' CE2' ' HE1' ' B' ' 17' ' ' MET . 2.6 m-85 -126.75 -71.59 0.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.461 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 3.7 m-20 162.02 113.8 0.01 OUTLIER Pre-proline 0 N--CA 1.453 -0.309 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.806 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 44.7 Cg_exo -35.63 148.25 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.523 2.149 . . . . 0.0 112.7 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.694 ' O ' ' HB3' ' B' ' 87' ' ' LYS . 2.1 m -123.98 136.73 54.49 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.102 0.561 . . . . 0.0 110.258 -0.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.776 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 62.5 m95 -103.03 129.0 49.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.211 0.529 . . . . 0.0 112.254 -178.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.822 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 7.8 m-70 -112.33 115.88 29.46 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.944 ' HB3' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -134.32 170.32 15.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.693 0.758 . . . . 0.0 112.687 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 0.854 HG12 ' H ' ' A' ' 65' ' ' TYR . 43.8 mt -149.54 165.94 3.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.341 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.059 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.4 p -161.06 116.02 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 0.0 111.13 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.725 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.38 -113.04 1.22 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.234 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.814 ' CZ ' ' HB3' ' A' ' 61' ' ' ASN . 0.0 OUTLIER 174.59 -4.6 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 120.579 0.228 . . . . 0.0 111.59 -179.594 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.583 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -170.86 34.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.434 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' B' ' 63' ' ' GLY . 9.5 p90 -99.84 -169.61 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.092 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.673 ' HA3' ' N ' ' A' ' 36' ' ' LYS . . . -147.5 96.69 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.742 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.995 ' CB ' HD12 ' A' ' 57' ' ' ILE . 8.8 p -81.46 149.15 28.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.141 0.496 . . . . 0.0 111.78 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.815 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 15.9 t80 -152.2 69.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.147 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 1.046 HG13 HD11 ' A' ' 57' ' ' ILE . 10.2 m -114.68 150.25 16.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.322 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.892 HG21 ' CG2' ' A' ' 53' ' ' THR . 5.2 t -77.26 119.49 20.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.082 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.557 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -83.72 148.05 27.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.71 179.807 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.755 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.88 -105.44 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.163 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.613 ' CG2' ' HB2' ' B' ' 87' ' ' LYS . 0.2 OUTLIER -37.54 -101.58 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.479 -179.728 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.62 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 2.9 mmtp -80.81 55.91 2.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.789 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.737 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 9.5 m80 30.99 -89.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.894 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.777 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 0.2 OUTLIER 165.18 -179.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.519 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 1.024 HD12 ' HA ' ' B' ' 18' ' ' GLN . 1.1 tt -151.83 115.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.639 ' HE2' ' HG ' ' B' ' 64' ' ' SER . 0.9 OUTLIER -111.39 92.76 4.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.812 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.98 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.2 p90 -111.04 168.85 9.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.647 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 49.1 t80 -130.64 112.98 13.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.618 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 1.051 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -69.16 170.36 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.75 -48.74 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.781 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.514 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 0.7 OUTLIER -145.95 37.57 1.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.862 0.363 . . . . 0.0 110.987 179.814 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.679 HG12 ' N ' ' B' ' 82' ' ' ALA . 69.5 t -154.68 169.08 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.01 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.969 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.6 157.74 40.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.664 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.969 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -145.07 117.12 2.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.979 0.419 . . . . 0.0 111.548 -179.702 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 0.9 HD22 ' HB3' ' B' ' 64' ' ' SER . 0.1 OUTLIER -106.74 92.29 4.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.177 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 1.019 HD11 HG21 ' B' ' 42' ' ' ILE . 0.2 OUTLIER -96.3 143.74 27.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.529 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.763 ' CE1' HG21 ' B' ' 66' ' ' VAL . 2.4 p90 179.17 136.97 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.729 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.776 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -103.74 162.88 12.72 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.647 179.506 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.822 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.4 OUTLIER -119.52 21.02 12.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.797 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.495 -179.954 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LYS . . . . . 0.427 ' C ' HD13 ' A' ' 78' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.867 0.365 . . . . 0.0 110.645 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 1.089 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.11 -165.48 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.398 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.574 ' N ' ' O ' ' A' ' 77' ' ' TYR . 79.4 t -155.21 73.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ILE . . . . . 0.947 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.52 158.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.191 0.52 . . . . 0.0 110.77 -179.515 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.761 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 6.9 mmtt -156.87 -11.91 0.09 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.1 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASN . . . . . 0.501 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.1 OUTLIER -169.39 87.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.502 -179.817 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.949 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -123.61 95.77 4.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.836 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.781 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 8.4 m-20 -84.78 36.49 0.61 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.275 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.859 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 14.2 ttp -125.19 164.41 20.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.051 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.613 ' H ' ' HG3' ' A' ' 13' ' ' MET . 52.8 p -55.81 123.89 15.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.859 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 8.8 mt-10 -29.35 -68.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.351 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -44.38 -41.83 6.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . 0.802 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -65.69 -31.02 71.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.143 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.949 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -71.74 -34.54 69.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.023 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLN . . . . . 0.553 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -75.27 -40.45 58.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.198 0.523 . . . . 0.0 110.043 179.603 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.37 -26.27 62.72 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.825 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.843 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 35.1 t -71.34 -43.74 66.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.197 179.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 18' ' ' GLN . 40.5 t -61.01 -46.2 97.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.354 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.643 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 64.9 mt-10 -57.68 -43.11 84.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.312 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.564 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 3.3 m -64.21 -36.62 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.199 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.99 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -69.83 -33.47 72.34 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.583 ' HA ' HD12 ' A' ' 29' ' ' LEU . 24.0 m -68.86 -38.09 79.5 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.154 -1.384 . . . . 0.0 109.675 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.777 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 21.7 mm100 -60.34 -40.67 91.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.98 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.936 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -69.28 -33.58 73.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.743 179.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.862 HD21 HG11 ' A' ' 81' ' ' VAL . 1.2 mt -67.94 -45.93 72.9 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -26.5 65.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.714 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.777 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 5.9 mttp -88.75 -25.72 22.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.844 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.522 ' HE1' ' CB ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -160.07 140.66 11.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.584 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.523 ' C ' HD13 ' A' ' 34' ' ' ILE . 1.4 t-20 -103.57 30.15 5.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 0.0 110.946 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 1.009 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.9 mm -112.5 104.81 17.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.112 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 1.023 ' HA ' HD12 ' A' ' 38' ' ' ILE . 13.2 mp0 -24.34 -79.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.2 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.657 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.2 OUTLIER -40.19 -48.07 2.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.766 179.737 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 1.009 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -56.8 -54.66 43.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.793 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 1.023 HD12 ' HA ' ' A' ' 35' ' ' GLU . 2.8 mt -50.46 -48.82 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.989 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -55.46 -61.98 1.98 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.846 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.822 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -39.81 -59.67 1.13 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.936 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -49.45 -51.54 34.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.206 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.99 HG12 ' HA ' ' A' ' 25' ' ' ALA . 8.2 mt -54.04 -65.31 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.225 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.74 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 22.6 tttm -46.86 -69.47 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.066 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 44' ' ' LYS . 15.3 mmtt -33.18 -59.0 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.969 -179.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.747 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 3.8 tp10 -65.08 -30.67 71.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.706 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . 0.843 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -79.1 -7.48 58.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.244 -179.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.808 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 7.0 m-20 -101.45 -29.07 12.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.158 0.504 . . . . 0.0 110.04 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.577 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -93.76 -23.38 18.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.867 179.805 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.747 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -89.48 -17.27 28.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.217 -179.676 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.745 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 4.2 m-85 -137.91 -64.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.338 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.745 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 0.1 OUTLIER 157.24 119.05 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.113 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.754 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.808 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 39.5 Cg_endo -66.07 170.47 11.71 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 122.56 2.174 . . . . 0.0 112.465 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.752 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 0.3 OUTLIER -104.4 132.39 50.7 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.834 0.453 . . . . 0.0 110.634 -0.147 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' TRP . . . . . 0.773 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 42.7 m95 -99.78 92.46 5.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.298 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' HIS . . . . . 0.78 ' C ' HG12 ' B' ' 66' ' ' VAL . 2.4 m170 -62.12 88.85 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 1.082 ' HB2' HD12 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -103.66 131.08 51.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.306 -178.232 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.977 ' CG1' HD23 ' A' ' 84' ' ' LEU . 19.3 mm -123.7 100.31 7.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.566 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . 0.989 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.0 p -98.71 118.43 45.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.883 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -138.72 -128.66 2.6 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.847 -0.692 . . . . 0.0 111.902 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.575 ' HE ' ' HB3' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -165.75 -1.59 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.762 0.315 . . . . 0.0 111.051 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASN . . . . . 0.673 HD22 ' HE ' ' B' ' 60' ' ' ARG . 16.8 t30 174.72 35.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.924 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.816 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 6.7 p90 -87.08 166.56 14.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.051 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.877 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -116.35 84.32 0.36 Allowed Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.821 ' CB ' HD22 ' A' ' 84' ' ' LEU . 90.0 p -80.84 125.19 29.78 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.105 0.479 . . . . 0.0 111.947 -178.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.81 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 36.5 t80 -131.42 66.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.708 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.851 HG12 ' HB3' ' B' ' 55' ' ' HIS . 3.0 m -99.8 172.67 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.266 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.808 HG21 HG21 ' B' ' 53' ' ' THR . 15.5 m -111.02 72.98 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.703 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' HIS . . . . . 0.509 ' NE2' ' OD2' ' A' ' 12' ' ' ASP . 24.1 p-80 -56.44 -164.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.205 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.462 ' N ' ' CD2' ' A' ' 68' ' ' HIS . 11.4 pt-20 168.37 -153.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.667 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.487 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER 51.88 -99.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.776 ' O ' ' HA ' ' A' ' 13' ' ' MET . 3.0 pttt 173.67 20.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.79 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.859 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 62.7 m-70 -121.78 43.72 2.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.757 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . 0.781 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 3.7 t80 -116.06 110.7 19.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.499 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.833 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.3 tt -123.65 127.12 73.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.317 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ASN . 58.6 t80 -120.96 110.12 15.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.451 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.947 ' HB3' HG13 ' A' ' 8' ' ' ILE . 2.2 p90 -135.68 173.89 11.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.24 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.716 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 28.4 t80 -127.23 113.95 17.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.052 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.089 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -78.4 -178.3 5.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.684 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . 0.623 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -60.42 90.82 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.074 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLN . . . . . 0.716 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 31.6 mt-30 78.19 21.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.865 0.364 . . . . 0.0 110.622 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' VAL . . . . . 0.862 HG11 HD21 ' A' ' 29' ' ' LEU . 90.0 t -151.2 171.54 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.881 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ALA . . . . . 0.782 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -147.95 153.61 39.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.013 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.782 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.3 OUTLIER -136.29 127.29 42.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.134 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.977 HD23 ' CG1' ' A' ' 57' ' ' ILE . 4.1 tp -111.69 86.6 2.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.651 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 1.082 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -93.34 125.99 38.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 -179.67 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.787 ' CE1' HG21 ' A' ' 66' ' ' VAL . 7.5 p90 -166.72 134.74 2.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . 0.752 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.99 -162.16 0.88 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.648 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' SER . . . . . 0.459 ' HA ' ' OE2' ' A' ' 69' ' ' GLU . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.309 0 CA-C-O 121.176 0.512 . . . . 0.0 110.981 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' ARG . . . . . 0.443 ' HA ' ' HD3' ' B' ' 4' ' ' ARG . 6.6 mmt85 . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.83 0.348 . . . . 0.0 110.717 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' B' ' 6' ' ' ALA . 0.0 OUTLIER 62.07 -174.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.894 179.798 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' ALA . . . . . 0.997 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 71.77 170.11 0.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.447 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' VAL . . . . . 0.661 HG12 ' HE2' ' B' ' 9' ' ' LYS . 89.6 t -134.65 66.96 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.369 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' ILE . . . . . 0.767 ' HA ' ' O ' ' B' ' 75' ' ' TYR . 0.8 OUTLIER -28.95 140.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.917 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' LYS . . . . . 0.661 ' HE2' HG12 ' B' ' 7' ' ' VAL . 5.7 mmtt -132.13 -0.36 3.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.628 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' ASN . . . . . 0.499 ' HB2' ' O ' ' B' ' 9' ' ' LYS . 0.1 OUTLIER 171.56 87.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.733 -179.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.936 ' HB1' HE21 ' B' ' 18' ' ' GLN . . . -119.4 89.86 3.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.57 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' ASP . . . . . 0.635 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -91.02 30.05 1.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.459 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.672 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -117.7 168.42 10.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.761 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' SER . . . . . 0.831 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 0.4 OUTLIER -43.02 141.63 1.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.977 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' GLU . . . . . 0.75 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -52.49 -58.28 7.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.674 179.718 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' GLU . . . . . 0.753 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -57.79 -26.3 61.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.51 179.624 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' MET . . . . . 0.831 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -74.27 -44.3 53.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' GLN . . . . . 1.034 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -65.46 -37.29 86.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.603 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -75.32 -41.06 57.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.635 179.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' ASP . . . . . 0.753 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.4 OUTLIER -69.81 -27.96 65.32 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.482 178.839 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' SER . . . . . 0.786 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -67.37 -47.35 70.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.091 179.173 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.904 HG22 ' CD2' ' B' ' 76' ' ' PHE . 73.9 t -58.22 -48.65 84.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.438 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -56.1 -39.32 71.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.404 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' CYS . . . . . 0.548 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -65.61 -36.02 82.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.985 0.421 . . . . 0.0 110.045 179.319 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.778 ' C ' HD12 ' B' ' 29' ' ' LEU . . . -68.81 -35.68 77.3 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.585 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 4.1 m -65.45 -44.25 87.81 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.744 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' GLN . . . . . 0.759 ' O ' ' HD2' ' B' ' 31' ' ' LYS . 10.6 mm100 -51.99 -49.32 63.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.686 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' ALA . . . . . 0.827 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -75.42 -16.13 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.605 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.778 HD12 ' C ' ' B' ' 25' ' ' ALA . 5.2 mt -82.12 -33.8 29.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.246 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -85.11 -33.66 22.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.386 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . 0.759 ' HD2' ' O ' ' B' ' 27' ' ' GLN . 0.1 OUTLIER -78.68 -29.25 45.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.952 0.406 . . . . 0.0 110.548 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' TYR . . . . . 0.63 ' CD1' ' N ' ' B' ' 32' ' ' TYR . 0.0 OUTLIER -149.39 151.65 34.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.64 179.789 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' ASN . . . . . 0.612 ' C ' HD13 ' B' ' 34' ' ' ILE . 12.2 m-80 -115.29 30.54 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.957 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' ILE . . . . . 0.953 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.1 mm -109.29 106.83 21.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' GLU . . . . . 0.877 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.0 mm-40 -31.6 -70.21 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.9 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' LYS . . . . . 0.509 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 5.2 mtmm -45.91 -61.05 1.9 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.873 0.368 . . . . 0.0 110.594 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' ASP . . . . . 0.953 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.1 m-20 -44.68 -63.6 0.87 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.765 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . 0.827 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 4.4 mt -43.63 -57.28 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.141 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' ALA . . . . . 1.05 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.14 -41.55 36.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -59.96 -64.49 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.059 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' HIS . . . . . 0.577 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -47.34 -39.37 14.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.99 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' ILE . . . . . 0.716 HG21 HD11 ' B' ' 85' ' ' LEU . 81.9 mt -59.1 -60.98 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.973 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' LYS . . . . . 0.822 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.1 OUTLIER -46.34 -55.58 7.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.893 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' LYS . . . . . 0.595 ' O ' ' HB3' ' B' ' 48' ' ' LYS . 0.1 OUTLIER -53.85 -35.79 61.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 -179.893 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' GLU . . . . . 0.739 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 5.2 mm-40 -74.43 -40.32 62.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.368 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' PHE . . . . . 0.786 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.77 -35.03 72.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 110.715 179.99 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' ASP . . . . . 0.807 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.9 m-20 -74.18 -31.47 62.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.0 109.91 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' LYS . . . . . 0.595 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -90.0 -24.17 21.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.663 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' LYS . . . . . 0.739 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.24 -30.41 17.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' TYR . . . . . 0.668 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 28.4 m-85 -123.85 -59.55 1.51 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.599 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' ASN . . . . . 0.503 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER 155.32 118.92 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.097 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.093 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' PRO . . . . . 0.807 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 18.1 Cg_endo -58.15 167.97 4.07 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.44 2.094 . . . . 0.0 112.502 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' THR . . . . . 0.808 HG21 HG21 ' A' ' 67' ' ' THR . 11.3 t -110.71 120.03 41.06 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.749 0.42 . . . . 0.0 110.653 0.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' TRP . . . . . 0.83 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 27.6 m95 -92.7 117.01 29.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.918 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' HIS . . . . . 0.851 ' HB3' HG12 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -85.15 91.33 8.1 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.928 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' CYS . . . . . 0.822 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 5.7 p -101.8 150.5 23.09 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -177.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' ILE . . . . . 1.017 HG13 HD23 ' B' ' 84' ' ' LEU . 13.3 mm -130.56 159.34 42.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.883 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' VAL . . . . . 1.05 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.3 p -162.03 108.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.89 0.376 . . . . 0.0 111.046 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' GLY . . . . . 0.818 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -129.21 -133.93 3.7 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.953 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' ARG . . . . . 0.673 ' HE ' HD22 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -165.83 -9.17 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.707 0.289 . . . . 0.0 111.36 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' ASN . . . . . 0.575 ' HB3' ' HE ' ' A' ' 60' ' ' ARG . 0.6 OUTLIER -170.54 34.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.367 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.883 ' HB2' ' HA3' ' A' ' 59' ' ' GLY . 17.5 p90 -103.05 -168.61 1.54 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 0.0 110.682 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' GLY . . . . . 0.853 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -143.33 106.12 0.41 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.041 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.951 ' HB2' HD22 ' B' ' 84' ' ' LEU . 63.1 p -89.81 134.93 33.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.082 0.467 . . . . 0.0 111.47 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' TYR . . . . . 0.822 ' CE2' ' HA ' ' A' ' 40' ' ' ALA . 56.3 t80 -144.96 79.34 1.59 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.997 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.842 HG13 HD11 ' A' ' 57' ' ' ILE . 4.9 m -131.51 166.75 27.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.565 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' THR . . . . . 0.614 HG22 ' NE2' ' A' ' 55' ' ' HIS . 1.6 t -79.32 170.11 17.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.584 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' HIS . . . . . 0.818 ' HB3' ' CD2' ' B' ' 73' ' ' PHE . 2.4 p-80 -129.85 154.9 46.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' GLU . . . . . 0.711 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.0 OUTLIER -143.32 170.41 15.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.815 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' THR . . . . . 0.434 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 44.49 -95.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.122 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' LYS . . . . . 0.623 ' O ' ' HB2' ' B' ' 13' ' ' MET . 7.1 mmtt -92.17 35.05 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.098 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' HIS . . . . . 0.751 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 13.5 m-70 51.08 -85.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.084 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' ' HB3' ' B' ' 68' ' ' HIS . 0.3 OUTLIER 165.52 -166.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.706 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 1.034 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -162.22 124.38 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.99 0.424 . . . . 0.0 111.666 179.529 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' TYR . . . . . 0.97 ' CZ ' HD13 ' B' ' 84' ' ' LEU . 0.5 OUTLIER -113.82 146.38 40.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.92 178.87 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . 0.909 ' HE1' HG23 ' B' ' 74' ' ' ILE . 1.4 p90 -170.33 149.15 3.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.849 0.357 . . . . 0.0 111.184 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' TYR . . . . . 0.603 ' O ' ' N ' ' B' ' 7' ' ' VAL . 1.3 t80 -113.99 112.03 22.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.83 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' LEU . . . . . 0.997 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -69.18 169.67 11.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.555 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' GLY . . . . . 0.49 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.53 -42.64 0.02 OUTLIER Glycine 0 CA--C 1.518 0.232 0 C-N-CA 121.088 -0.577 . . . . 0.0 112.89 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' GLN . . . . . 0.74 HE21 ' HA ' ' B' ' 80' ' ' GLN . 0.0 OUTLIER -153.55 40.1 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.971 0.415 . . . . 0.0 110.618 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' VAL . . . . . 0.818 HG13 ' O ' ' B' ' 59' ' ' GLY . 77.9 t -156.4 168.46 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.055 -179.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' ALA . . . . . 0.999 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.58 157.48 41.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.578 179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . 0.999 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -148.57 132.02 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 0.0 111.831 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' LEU . . . . . 1.017 HD23 HG13 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -125.19 101.32 6.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.257 179.332 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' LEU . . . . . 0.796 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 3.6 mp -101.1 133.73 45.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.12 -179.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' PHE . . . . . 0.704 ' CE1' ' HB2' ' B' ' 55' ' ' HIS . 3.2 p90 -172.68 122.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.421 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' LYS . . . . . 0.83 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -104.75 168.34 9.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.658 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' SER . . . . . 0.711 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 4.3 m -122.15 19.45 10.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.319 0.58 . . . . 0.0 110.815 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.437 -1.202 . . . . 0.0 112.546 -179.968 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.809 0.338 . . . . 0.0 111.248 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -134.15 129.73 36.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.974 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.567 ' OD2' ' HB3' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -85.99 -135.28 0.07 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.827 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.488 ' H ' ' HB2' ' A' ' 3' ' ' ASP . 1.1 ttt180 51.71 11.4 0.13 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.9 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.755 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 17.6 tptp -74.76 43.09 0.18 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.051 -179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.05 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -110.23 -172.01 1.95 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.954 0.407 . . . . 0.0 111.263 179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.502 ' N ' ' O ' ' A' ' 77' ' ' TYR . 95.6 t -140.04 77.35 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.747 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.804 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -42.85 149.86 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 121.064 0.459 . . . . 0.0 110.839 -179.747 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.505 ' HE3' ' HB2' ' A' ' 77' ' ' TYR . 2.4 mmtt -137.71 -13.85 1.46 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.329 179.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -176.32 112.25 0.1 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.45 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.766 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -131.71 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.209 0.528 . . . . 0.0 111.682 -179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.71 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -137.87 25.86 2.77 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.509 -0.769 . . . . 0.0 109.694 179.326 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.811 ' SD ' ' HE2' ' A' ' 17' ' ' MET . 25.7 ttp -117.08 166.44 12.21 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.723 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.988 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 74.4 m -51.92 135.93 29.49 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.715 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.723 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -41.81 -77.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.742 -179.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.635 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.7 OUTLIER -45.95 -19.46 0.07 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.474 179.792 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.988 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.16 -42.22 26.67 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.45 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.861 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -69.27 -28.37 66.25 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.492 179.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.692 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 2.2 pt20 -75.78 -45.79 34.26 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 109.404 -0.591 . . . . 0.0 109.404 179.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.692 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 2.1 m-20 -67.11 -30.82 70.95 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.76 179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.852 ' OG ' HD22 ' A' ' 85' ' ' LEU . 29.0 t -65.08 -47.61 76.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.922 179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.811 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 56.4 t -57.85 -48.09 84.66 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.799 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.619 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 52.3 mt-10 -60.74 -38.3 84.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.353 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.625 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 57.1 m -66.41 -34.08 77.14 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.193 0.521 . . . . 0.0 109.668 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.898 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -70.21 -39.9 74.89 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 108.24 -1.022 . . . . 0.0 108.24 178.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.589 ' HA ' HD12 ' A' ' 29' ' ' LEU . 55.2 m -66.09 -38.88 89.35 Favored 'General case' 0 N--CA 1.445 -0.677 0 CA-C-N 114.277 -1.329 . . . . 0.0 109.958 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.594 ' HA ' ' OE1' ' A' ' 27' ' ' GLN . 7.6 mm-40 -58.19 -41.59 84.28 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.806 179.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.882 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -70.97 -29.14 65.04 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.794 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.898 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.0 OUTLIER -72.05 -41.92 66.89 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.026 179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.21 -36.55 77.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.184 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.523 ' HD3' ' CE1' ' A' ' 41' ' ' HIS . 2.1 mttp -79.73 -25.72 41.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.738 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.581 ' CE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.43 143.34 18.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.838 179.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -108.61 30.3 6.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.901 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.929 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 8.0 mm -110.53 111.23 35.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.849 179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.741 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 8.5 mp0 -28.47 -82.72 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.823 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.547 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -37.19 -48.62 0.86 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.551 179.519 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.929 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 2.6 t70 -53.09 -63.53 1.12 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.538 179.56 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.804 ' HB ' HG11 ' A' ' 58' ' ' VAL . 5.3 mt -46.32 -47.06 6.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.805 179.464 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 1.026 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -56.53 -50.71 71.05 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.001 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.811 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -57.59 -55.46 34.6 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.775 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.882 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 1.2 t60 -47.1 -46.92 23.16 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.564 179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.805 HG21 HD11 ' A' ' 85' ' ' LEU . 49.6 mt -61.1 -71.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.074 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.793 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 1.1 tmtt? -42.64 -40.56 2.78 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.151 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.467 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 24.3 tptt -55.57 -62.28 1.79 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.171 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.65 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mp0 -62.76 -49.83 73.47 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.15 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.794 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -55.18 -35.67 65.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.26 -179.687 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.793 ' HB2' ' HE2' ' A' ' 43' ' ' LYS . 0.8 OUTLIER -72.02 -38.06 69.64 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.108 -179.867 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.08 9.23 43.18 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.106 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.65 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -128.92 5.17 5.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.164 -179.862 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.779 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 63.9 m-85 -144.61 -66.75 0.33 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.035 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.779 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 5.6 p30 162.57 109.18 0.01 OUTLIER Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.187 -179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.7 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 77.0 Cg_exo -47.77 149.44 5.18 Favored 'Trans proline' 0 CA--C 1.531 0.332 0 C-N-CA 122.432 2.088 . . . . 0.0 112.477 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.799 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 11.0 t -119.51 135.82 54.61 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.056 0.542 . . . . 0.0 110.657 -0.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.716 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 47.4 m95 -96.67 124.61 40.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.02 0.438 . . . . 0.0 111.741 -179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.736 ' HB3' ' CB ' ' B' ' 66' ' ' VAL . 0.0 OUTLIER -107.94 101.98 11.21 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 178.726 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.999 ' HB2' HD12 ' A' ' 85' ' ' LEU . 1.9 p -116.86 152.17 35.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.265 0.555 . . . . 0.0 112.425 -178.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.055 HG21 HG21 ' B' ' 57' ' ' ILE . 20.8 mm -130.36 110.96 19.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.379 179.193 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.026 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.4 p -105.18 121.23 56.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.38 -179.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.696 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -162.42 176.35 38.78 Favored Glycine 0 N--CA 1.449 -0.498 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.144 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.694 ' HB3' ' HA ' ' A' ' 81' ' ' VAL . 0.1 OUTLIER -138.07 40.97 2.3 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.651 0.262 . . . . 0.0 111.297 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.712 ' O ' ' HG2' ' B' ' 60' ' ' ARG . 2.5 t-20 168.61 25.46 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.885 0.374 . . . . 0.0 111.208 179.674 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.932 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 15.1 p90 -109.34 -166.95 1.15 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.609 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.851 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -150.71 102.88 0.24 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 121.047 -0.597 . . . . 0.0 111.97 179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.956 ' CB ' HD12 ' B' ' 57' ' ' ILE . 88.4 p -86.11 134.57 33.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.096 0.474 . . . . 0.0 111.584 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.829 ' HB3' ' HB1' ' B' ' 39' ' ' ALA . 60.1 t80 -149.83 87.49 1.49 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.057 179.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.871 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 11.5 m -132.66 168.1 25.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.216 -179.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.928 HG21 ' CG2' ' B' ' 53' ' ' THR . 13.2 t -92.14 83.23 5.07 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.892 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.571 ' C ' ' HG2' ' A' ' 69' ' ' GLU . 32.2 p-80 -55.68 -179.24 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.49 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HG2' ' C ' ' A' ' 68' ' ' HIS . 0.7 OUTLIER 176.38 -166.74 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.918 0.39 . . . . 0.0 111.228 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.49 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 58.86 -100.23 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.836 179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.49 ' H ' ' HB ' ' A' ' 70' ' ' THR . 1.3 mtmp? 179.15 28.63 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.991 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.79 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 3.7 m-70 -138.27 54.12 1.79 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.348 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.828 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.1 t80 -125.04 89.93 3.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.186 179.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.861 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.2 tt -109.55 142.44 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-O 120.953 0.406 . . . . 0.0 111.673 -179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.63 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 21.6 t80 -130.96 131.55 44.49 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.063 179.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.811 ' CE2' ' HA ' ' A' ' 22' ' ' VAL . 1.2 p90 -154.85 179.27 9.26 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.152 -179.408 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.751 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 24.4 t80 -137.91 104.15 5.18 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.698 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.05 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.3 mm? -58.86 173.74 0.41 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.083 -179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.456 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.15 -44.59 0.17 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 121.039 -0.6 . . . . 0.0 112.872 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.661 ' O ' ' HG3' ' A' ' 80' ' ' GLN . 9.6 tp-100 -144.8 25.58 1.44 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.609 0.242 . . . . 0.0 111.323 -179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.829 HG12 ' H ' ' A' ' 82' ' ' ALA . 13.9 t -146.79 178.04 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-O 120.841 0.353 . . . . 0.0 111.111 -179.914 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.847 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -141.11 154.07 45.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.842 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.847 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -139.26 137.26 41.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.154 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.001 HD23 HG12 ' A' ' 57' ' ' ILE . 3.0 tp -121.89 81.81 1.87 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.573 -179.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.999 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -85.87 126.66 34.23 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.329 -179.616 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.828 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -168.7 125.0 0.97 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.497 179.611 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.799 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -98.59 -171.27 2.09 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.631 179.492 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.544 ' CB ' ' HE1' ' A' ' 55' ' ' HIS . 0.5 OUTLIER -125.97 20.17 7.67 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.238 0.542 . . . . 0.0 110.641 179.919 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.456 ' HA3' HG21 ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.251 1.166 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.47 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.819 0.342 . . . . 0.0 111.258 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -147.83 63.4 1.12 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.036 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 34.5 t0 53.93 -113.27 0.77 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.695 179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.668 ' HD2' ' HA ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER 53.03 72.07 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.129 179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.59 ' C ' HD13 ' B' ' 78' ' ' LEU . 5.9 tppt? -93.51 47.21 1.23 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.091 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.019 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.32 -175.5 3.4 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.428 . . . . 0.0 111.301 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' B' ' 77' ' ' TYR . 69.3 t -141.2 74.03 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.774 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.973 HD11 HD11 ' B' ' 74' ' ' ILE . 1.1 mp -34.1 157.33 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.074 -179.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.752 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 6.1 mmpt? -146.4 -15.08 0.44 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.936 179.541 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.493 HD22 ' HA ' ' B' ' 10' ' ' ASN . 0.1 OUTLIER 179.81 102.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.486 -179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.858 ' HB1' ' NE2' ' B' ' 18' ' ' GLN . . . -130.52 104.54 7.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.899 0.381 . . . . 0.0 111.935 -179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.604 ' N ' ' O ' ' B' ' 73' ' ' PHE . 4.4 t70 -89.21 30.6 0.95 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.154 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.914 ' SD ' ' HE2' ' B' ' 17' ' ' MET . 28.4 ttp -120.96 156.06 32.9 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.909 -179.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.76 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.8 OUTLIER -46.98 135.78 9.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.59 179.646 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.762 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 10.6 mm-40 -41.36 -69.7 0.13 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.226 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.578 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 18.0 mm-40 -44.99 -37.97 4.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.891 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.914 ' HE2' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -65.64 -33.23 75.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.61 179.74 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.886 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.37 -29.48 63.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.103 -179.989 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.668 ' HA ' ' HD2' ' B' ' 4' ' ' ARG . 6.7 pt20 -75.9 -41.74 51.13 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.076 0.465 . . . . 0.0 110.382 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -73.41 -28.83 62.21 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.887 179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.917 ' OG ' HD22 ' B' ' 85' ' ' LEU . 1.8 t -67.6 -44.27 78.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.184 179.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.882 HG23 ' O ' ' B' ' 18' ' ' GLN . 47.2 t -63.26 -48.51 87.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.766 179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 85.8 mt-10 -55.06 -41.5 71.56 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.562 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 75.5 m -64.39 -37.76 88.64 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.368 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.769 ' HB1' HD12 ' B' ' 83' ' ' ILE . . . -67.9 -28.22 67.32 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 178.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.645 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 3.0 m -71.67 -43.22 66.4 Favored 'General case' 0 N--CA 1.446 -0.653 0 CA-C-N 114.23 -1.35 . . . . 0.0 109.77 178.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.429 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 1.2 mt-30 -53.13 -46.62 68.86 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.619 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.717 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -77.22 -20.26 55.52 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.291 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 1.072 HD21 HG11 ' B' ' 81' ' ' VAL . 6.3 mt -77.19 -32.96 56.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.11 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -89.42 -27.45 20.39 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.371 -179.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.752 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 41.9 mmtm -83.47 -29.32 28.11 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-O 120.917 0.389 . . . . 0.0 110.705 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.752 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -152.68 141.09 20.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.566 179.445 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -105.71 29.39 6.63 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.946 0.403 . . . . 0.0 110.955 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 1.031 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 7.5 mm -103.61 101.28 12.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.868 179.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.851 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.9 mp0 -29.83 -68.85 0.07 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.985 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.629 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -49.48 -56.2 10.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.431 -0.35 . . . . 0.0 110.818 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 1.031 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -49.27 -63.67 1.04 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.679 179.742 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.748 ' O ' HG13 ' B' ' 42' ' ' ILE . 38.8 mt -42.38 -46.31 1.08 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.935 179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.949 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -63.65 -40.64 97.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.925 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.709 ' HA ' ' CE1' ' A' ' 65' ' ' TYR . . . -57.67 -67.15 0.36 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.967 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.689 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -46.66 -57.31 4.93 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.728 179.957 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.748 HG13 ' O ' ' B' ' 38' ' ' ILE . 78.1 mt -43.59 -70.11 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.915 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.651 ' HB3' ' HE1' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -36.99 -48.09 0.75 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.325 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.462 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -59.38 -45.3 91.85 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.549 -179.601 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.683 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.7 OUTLIER -69.68 -46.9 65.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.359 -179.519 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.825 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -60.85 -33.0 72.39 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.979 -179.823 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.781 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.73 -50.2 26.18 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.721 179.789 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.937 ' HA ' ' HE3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -72.28 -22.36 61.22 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.935 179.886 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.683 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -90.45 -26.57 19.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.199 -179.813 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.703 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 15.2 m-85 -120.02 -65.35 1.16 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.192 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.703 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 21.7 t-20 160.27 110.19 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.201 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.96 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.781 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 81.2 Cg_exo -43.84 149.79 0.68 Allowed 'Trans proline' 0 CA--C 1.531 0.334 0 C-N-CA 122.49 2.127 . . . . 0.0 112.717 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.928 ' CG2' HG21 ' A' ' 67' ' ' THR . 0.2 OUTLIER -125.75 137.92 53.83 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 122.955 0.502 . . . . 0.0 110.549 -0.104 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.772 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 34.2 m95 -95.28 121.5 37.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.828 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.871 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -91.09 97.91 11.44 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.437 178.672 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 1.021 ' HB3' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -113.72 143.44 44.62 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.249 0.547 . . . . 0.0 112.448 -178.418 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 1.055 HG21 HG21 ' A' ' 57' ' ' ILE . 21.2 mm -130.11 97.21 3.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.06 178.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 0.949 HG12 ' HB2' ' B' ' 39' ' ' ALA . 3.3 p -98.48 129.69 48.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-O 120.971 0.415 . . . . 0.0 111.385 -179.441 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.733 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.96 -144.03 4.09 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.026 179.858 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.712 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.63 10.71 0.06 Allowed 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.756 0.312 . . . . 0.0 111.111 -179.659 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.519 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 2.2 t-20 175.98 30.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.933 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.932 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 9.5 p90 -102.13 -166.64 1.31 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.985 0.422 . . . . 0.0 110.976 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.741 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -147.82 86.76 0.16 Allowed Glycine 0 N--CA 1.45 -0.369 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.919 179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.975 ' CB ' HD12 ' A' ' 57' ' ' ILE . 8.3 p -73.28 141.64 47.2 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.935 0.398 . . . . 0.0 111.533 -179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.837 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 12.1 t80 -147.08 62.34 1.18 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.359 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.981 HG13 HD11 ' A' ' 57' ' ' ILE . 21.5 m -102.38 161.31 3.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.273 -179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.519 ' O ' ' HG2' ' B' ' 69' ' ' GLU . 18.4 m -99.13 94.5 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.846 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.728 ' HA ' ' HD2' ' B' ' 86' ' ' PHE . 0.0 OUTLIER -31.22 -44.48 0.07 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.163 -179.853 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.59 ' HG2' ' O ' ' B' ' 68' ' ' HIS . 19.3 pt-20 43.64 36.83 1.33 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.997 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.642 HG22 ' H ' ' B' ' 71' ' ' LYS . 3.0 m -170.16 -136.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.969 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.654 ' O ' ' HA ' ' B' ' 13' ' ' MET . 10.2 mtmm -146.43 12.47 1.19 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.71 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.852 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 8.4 m-70 -119.41 47.59 1.67 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.678 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.779 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 6.8 t80 -116.47 116.78 28.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.53 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.973 HD11 HD11 ' B' ' 8' ' ' ILE . 0.8 OUTLIER -135.85 125.76 41.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.999 0.428 . . . . 0.0 111.729 -179.911 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.752 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 16.6 t80 -112.07 136.64 51.19 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.803 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.949 ' HE1' HG23 ' B' ' 74' ' ' ILE . 2.3 p90 -162.56 164.1 26.98 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.891 0.376 . . . . 0.0 111.246 -179.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.518 ' O ' ' N ' ' B' ' 7' ' ' VAL . 65.4 t80 -122.52 109.62 14.56 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.015 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.019 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -70.27 170.37 11.85 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.629 179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.13 -47.03 0.02 OUTLIER Glycine 0 C--N 1.332 0.341 0 C-N-CA 121.191 -0.528 . . . . 0.0 112.932 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.458 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 2.8 mt-30 -149.56 37.18 0.74 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.905 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 1.072 HG11 HD21 ' B' ' 29' ' ' LEU . 85.6 t -154.02 170.84 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.162 -179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.726 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -137.43 141.72 41.62 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.505 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.866 HD11 HD11 ' B' ' 29' ' ' LEU . 0.2 OUTLIER -128.24 128.6 68.73 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-O 121.07 0.462 . . . . 0.0 111.678 -179.609 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.899 HD23 ' CG1' ' B' ' 57' ' ' ILE . 1.2 tp -116.31 85.3 2.28 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.031 179.369 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 1.021 HD12 ' HB3' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -93.03 128.94 39.09 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.573 -179.0 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.728 ' HD2' ' HA ' ' B' ' 68' ' ' HIS . 1.2 p90 -167.62 123.7 1.09 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.849 179.438 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.772 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 32.7 mtpt -91.59 159.88 15.68 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.753 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.662 ' H ' ' CE1' ' B' ' 55' ' ' HIS . 32.2 m -105.17 18.31 22.54 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.302 0.572 . . . . 0.0 110.799 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.069 0 CA-C-O 118.428 -1.207 . . . . 0.0 112.544 -179.962 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.6 mtp . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.837 0.351 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.41 ' C ' ' CG ' ' A' ' 3' ' ' ASP . 0.4 OUTLIER -133.49 -50.32 0.85 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.921 179.864 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.41 ' CG ' ' C ' ' A' ' 2' ' ' CYS . 0.0 OUTLIER 175.36 136.27 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.96 179.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.99 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.5 OUTLIER 54.62 24.48 5.5 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.708 179.879 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.638 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 20.7 tptm -79.75 67.19 5.45 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.177 -179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.086 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -135.9 -168.95 2.31 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.336 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.79 ' O ' ' HD2' ' A' ' 9' ' ' LYS . 73.6 t -145.67 72.35 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.932 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 1.065 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.6 OUTLIER -43.92 162.15 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-O 121.251 0.548 . . . . 0.0 111.09 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.79 ' HD2' ' O ' ' A' ' 7' ' ' VAL . 0.0 OUTLIER -149.82 -22.42 0.27 Allowed 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.243 -0.89 . . . . 0.0 109.343 179.095 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.663 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 54.8 t30 -156.5 165.52 36.06 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.265 179.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.666 ' HA ' ' CD1' ' A' ' 73' ' ' PHE . . . 166.54 127.97 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.985 0.422 . . . . 0.0 111.911 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.781 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 2.1 m-20 -118.36 26.93 9.27 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.872 178.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.899 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 28.6 ttp -108.91 167.04 10.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.823 -179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.69 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.1 OUTLIER -58.14 129.4 41.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.79 179.781 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.701 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 mt-10 -33.74 -66.72 0.15 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -50.55 -32.92 19.86 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.785 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.704 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 39.5 mmm -72.63 -33.72 66.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.17 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.895 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.49 -39.41 85.21 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.636 -179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.99 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 1.8 mt-30 -74.48 -34.3 63.08 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.24 -31.79 66.13 Favored 'General case' 0 N--CA 1.452 -0.365 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.848 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.751 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -67.34 -46.45 73.39 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.18 179.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.934 HG13 ' CE2' ' A' ' 76' ' ' PHE . 11.8 t -59.67 -45.16 94.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.541 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.641 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 43.0 mt-10 -59.64 -37.0 77.5 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.117 179.426 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.646 ' SG ' HG23 ' A' ' 42' ' ' ILE . 11.5 t -66.32 -40.22 89.79 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.159 179.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.74 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -67.49 -22.59 65.45 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 178.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.688 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 2.3 m -78.85 -46.39 18.72 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.581 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.57 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 7.4 mm100 -48.06 -45.23 32.16 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.417 178.814 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.748 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -77.47 -33.84 54.51 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.127 178.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.698 ' CD1' ' HG ' ' A' ' 78' ' ' LEU . 5.5 mt -63.75 -24.02 67.6 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.641 -0.709 . . . . 0.0 111.055 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -99.43 -28.65 13.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.554 -179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.805 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 29.5 mmtp -84.87 -27.27 26.81 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.756 0.312 . . . . 0.0 111.091 -179.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.805 ' CE1' ' HB2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -146.25 161.31 40.55 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.875 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.1 t30 -126.31 36.38 4.51 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.952 HG22 ' HD3' ' A' ' 36' ' ' LYS . 3.3 mm -120.15 97.43 5.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.829 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.673 ' C ' ' HA3' ' B' ' 63' ' ' GLY . 2.5 mp0 -22.5 -72.71 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.206 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.952 ' HD3' HG22 ' A' ' 34' ' ' ILE . 0.0 OUTLIER -47.62 -51.04 22.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.5 179.617 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.893 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.6 t0 -54.38 -62.39 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.52 179.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.754 ' O ' HG13 ' A' ' 42' ' ' ILE . 5.6 mt -43.51 -42.82 1.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.874 179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 1.061 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -65.6 -55.7 16.18 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.902 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.821 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -39.1 -51.39 1.88 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.938 0.399 . . . . 0.0 110.724 179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.548 ' CE1' ' CD1' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -64.91 -54.91 23.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.89 179.84 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.762 ' CG2' HD11 ' A' ' 85' ' ' LEU . 83.9 mt -45.72 -56.42 1.09 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.098 179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.502 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 0.1 OUTLIER -59.47 -70.9 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.966 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.546 ' HD2' ' C ' ' A' ' 44' ' ' LYS . 0.2 OUTLIER -34.1 -59.97 0.41 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.959 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.92 -46.76 84.5 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.941 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.751 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -59.76 -18.58 44.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.817 -179.928 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.715 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -87.84 -34.27 18.29 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.636 179.857 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmt -99.56 6.72 45.73 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.046 -0.524 . . . . 0.0 110.755 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.97 6.68 8.63 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.102 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.56 ' CD1' ' HE1' ' A' ' 17' ' ' MET . 95.2 m-85 -149.1 -67.3 0.22 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.468 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.738 ' O ' ' HE2' ' A' ' 87' ' ' LYS . 12.3 m-20 160.93 108.52 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.19 0 CA-C-N 116.469 -0.332 . . . . 0.0 110.432 -179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.715 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 92.0 Cg_exo -43.85 155.76 0.19 Allowed 'Trans proline' 0 CA--C 1.533 0.432 0 C-N-CA 122.47 2.113 . . . . 0.0 112.437 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.816 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.5 m -117.2 132.61 56.6 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 123.199 0.6 . . . . 0.0 110.485 -0.048 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.841 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 60.6 m95 -98.81 166.89 11.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.415 0.626 . . . . 0.0 111.951 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.88 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.0 OUTLIER -158.03 109.26 2.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.237 179.269 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.807 ' CB ' HD12 ' A' ' 85' ' ' LEU . 6.2 p -121.96 152.05 40.11 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.223 0.535 . . . . 0.0 112.425 -178.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.013 HD11 HG13 ' B' ' 66' ' ' VAL . 20.9 mm -129.13 105.93 13.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.391 178.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.061 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.6 p -104.13 124.33 58.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.915 0.388 . . . . 0.0 111.675 -179.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.879 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -149.65 -131.45 1.94 Allowed Glycine 0 N--CA 1.449 -0.45 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.758 179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.628 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -160.02 5.64 0.09 Allowed 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 120.657 0.265 . . . . 0.0 111.475 -179.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.628 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 41.8 t30 166.7 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.763 0.315 . . . . 0.0 111.312 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.748 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 45.9 p90 -77.5 -178.33 5.19 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.0 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.62 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.94 76.94 0.39 Allowed Glycine 0 N--CA 1.453 -0.211 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.177 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.945 ' HA ' HG23 ' B' ' 57' ' ' ILE . 88.6 p -69.98 151.97 44.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.881 0.372 . . . . 0.0 111.354 -179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.801 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 11.6 t80 -164.22 56.81 0.15 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.589 179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.756 HG11 ' CZ ' ' A' ' 86' ' ' PHE . 6.9 m -80.83 -161.12 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.049 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.781 HG21 ' OG1' ' B' ' 53' ' ' THR . 1.2 m -157.03 96.47 1.59 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.221 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.628 ' CD2' ' N ' ' A' ' 69' ' ' GLU . 42.6 t60 -175.68 -97.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.846 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.636 ' HB3' ' HB2' ' A' ' 12' ' ' ASP . 0.6 OUTLIER 43.75 75.28 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.973 -179.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 8.2 m -101.99 -37.27 8.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.984 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.781 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 4.3 ptpt -177.67 12.18 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.941 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.932 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 61.6 m-70 -136.97 23.99 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.822 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.849 ' HD2' ' HB3' ' A' ' 86' ' ' PHE . 14.1 t80 -105.63 168.8 8.85 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.852 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.895 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.4 tt 171.54 119.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.124 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.426 ' O ' ' HD3' ' A' ' 9' ' ' LYS . 3.5 t80 -116.52 111.33 19.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.809 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 1.065 ' HB3' HG13 ' A' ' 8' ' ' ILE . 1.0 OUTLIER -130.98 176.46 8.22 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.221 -179.689 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.732 ' CB ' ' HE2' ' A' ' 9' ' ' LYS . 20.2 t80 -135.93 103.97 5.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.756 179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.086 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -61.41 177.66 0.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.916 -179.925 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.83 -42.03 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.46 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.528 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 2.2 pm0 -154.53 43.04 0.5 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.862 0.363 . . . . 0.0 110.829 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.879 HG13 ' O ' ' A' ' 59' ' ' GLY . 55.6 t -154.49 166.85 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.116 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.63 ' N ' HG12 ' A' ' 81' ' ' VAL . . . -134.68 114.48 12.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.673 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.719 HG21 ' HB2' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -105.71 120.4 56.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 120.998 0.428 . . . . 0.0 111.429 -179.644 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.0 HD23 HG12 ' A' ' 57' ' ' ILE . 0.3 OUTLIER -105.06 91.78 3.95 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.316 179.602 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.807 HD12 ' CB ' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -95.86 127.11 41.6 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.012 0.434 . . . . 0.0 111.726 -179.282 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.849 ' HB3' ' HD2' ' A' ' 73' ' ' PHE . 30.0 p90 -158.06 144.48 17.51 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.742 179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.932 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -105.14 -170.23 1.72 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.957 0.408 . . . . 0.0 110.771 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.88 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -145.16 17.43 1.56 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.471 0.653 . . . . 0.0 109.994 179.533 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.636 ' H ' ' HZ2' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.351 -1.249 . . . . 0.0 112.521 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.524 ' C ' ' H ' ' B' ' 3' ' ' ASP . 5.3 ttt . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.838 0.351 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.517 ' O ' ' HD3' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -67.02 9.92 0.17 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.763 179.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.524 ' H ' ' C ' ' B' ' 1' ' ' MET . 6.4 t70 61.93 7.72 2.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.817 -179.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.772 ' HG2' ' CD ' ' B' ' 19' ' ' GLN . 0.1 OUTLIER -116.52 66.01 0.71 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.815 179.945 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.676 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.0 OUTLIER -80.44 118.67 22.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.011 -179.965 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.039 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 162.1 -167.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.116 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.675 ' O ' ' HG2' ' B' ' 9' ' ' LYS . 22.7 t -156.67 73.24 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.196 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.954 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -47.24 148.48 0.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 121.06 0.457 . . . . 0.0 110.535 179.882 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.755 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 2.8 mmtt -154.68 -1.95 0.17 Allowed 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.324 179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.906 ' HB3' ' HB3' ' B' ' 75' ' ' TYR . 0.3 OUTLIER -164.08 70.3 0.2 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.963 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.764 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -110.73 153.81 24.78 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.133 0.492 . . . . 0.0 111.511 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.6 ' HB3' ' HD2' ' B' ' 68' ' ' HIS . 6.9 t70 -149.85 28.92 0.76 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.015 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.925 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 11.9 ttp -121.48 170.82 9.29 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.66 -179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.723 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.3 OUTLIER -57.19 140.86 48.37 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.716 179.771 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.713 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 31.5 mp0 -46.0 -63.39 0.99 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.172 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.27 -28.69 19.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.004 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.925 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 53.4 mmm -79.63 -35.56 39.23 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.048 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.738 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -71.17 -35.67 71.72 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.921 0.391 . . . . 0.0 110.315 179.657 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.772 ' CD ' ' HG2' ' B' ' 4' ' ' ARG . 2.6 mm-40 -75.16 -36.56 61.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.182 0.515 . . . . 0.0 109.646 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.552 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 5.4 m-20 -70.35 -29.28 65.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.577 -0.738 . . . . 0.0 109.653 179.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.844 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -68.92 -49.22 59.96 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.905 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.819 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 77.6 t -54.28 -45.29 67.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.139 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 83.6 mt-10 -58.94 -39.6 82.13 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.878 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.543 ' SG ' HG23 ' B' ' 42' ' ' ILE . 13.3 t -65.22 -36.23 83.52 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.009 -0.542 . . . . 0.0 109.968 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.776 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -69.26 -29.56 67.49 Favored 'General case' 0 CA--C 1.511 -0.523 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 178.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.536 ' HA ' HD12 ' B' ' 29' ' ' LEU . 2.0 m -71.45 -37.69 71.36 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.294 -1.321 . . . . 0.0 109.825 178.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.421 ' O ' ' HB2' ' B' ' 31' ' ' LYS . 43.1 mt-30 -60.72 -42.73 97.86 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.692 179.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.939 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -73.42 -27.2 61.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.583 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.776 HD12 ' O ' ' B' ' 25' ' ' ALA . 2.5 mt -72.98 -49.19 30.52 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.87 179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.75 -26.64 63.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.747 -0.661 . . . . 0.0 111.024 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.646 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 2.6 mttp -86.73 -30.32 21.71 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.966 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.63 ' HE1' ' ND1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.6 163.91 36.58 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.005 179.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -126.42 27.75 6.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.75 179.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.695 ' HB ' ' CB ' ' B' ' 37' ' ' ASP . 9.2 mm -108.78 106.39 20.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.797 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.629 ' OE2' ' HA2' ' B' ' 59' ' ' GLY . 2.0 mm-40 -29.78 -71.03 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.937 -179.602 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.452 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -46.82 -48.05 20.92 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.869 0.366 . . . . 0.0 110.609 179.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.695 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 14.3 t0 -54.77 -60.81 2.86 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.648 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.939 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 3.9 mt -48.13 -49.1 12.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.516 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 1.067 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -56.6 -35.5 68.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.43 179.558 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.801 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -72.04 -63.64 1.1 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.317 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.741 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -37.47 -56.13 1.02 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.14 179.178 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.787 HD11 HG22 ' B' ' 38' ' ' ILE . 6.9 mt -56.56 -68.24 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 115.749 -0.66 . . . . 0.0 111.284 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.644 ' HE3' ' HE2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -38.94 -47.84 1.5 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.827 0.346 . . . . 0.0 111.146 -179.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.524 ' N ' ' HD2' ' B' ' 43' ' ' LYS . 0.4 OUTLIER -61.91 -53.11 60.3 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.185 -0.462 . . . . 0.0 111.462 -179.538 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.535 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 1.2 tp10 -60.83 -34.21 74.22 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.164 -179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.844 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -67.06 -49.04 66.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.821 0.343 . . . . 0.0 110.606 179.89 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.674 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -55.73 -37.66 68.73 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.554 179.803 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.86 -20.2 22.53 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.383 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.535 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 3.0 tttt -88.5 -13.35 40.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.787 0.327 . . . . 0.0 111.18 -179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.651 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 23.3 m-85 -142.49 -67.54 0.37 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.418 -179.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.651 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 30.8 t-20 160.22 117.32 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.18 0 CA-C-N 116.033 -0.53 . . . . 0.0 109.827 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.674 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 10.7 Cg_endo -53.28 168.96 0.5 Allowed 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.442 2.095 . . . . 0.0 112.511 -179.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.781 ' OG1' HG21 ' A' ' 67' ' ' THR . 8.6 t -109.99 122.45 47.61 Favored 'General case' 0 C--N 1.343 0.306 0 C-N-CA 122.833 0.453 . . . . 0.0 110.775 0.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.853 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 48.5 m95 -92.44 120.8 33.29 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.704 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.734 ' NE2' HG23 ' B' ' 53' ' ' THR . 0.2 OUTLIER -100.0 105.44 17.11 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 178.116 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.992 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -130.8 165.28 23.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.52 0.676 . . . . 0.0 112.183 -177.791 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.988 HD12 HG13 ' A' ' 57' ' ' ILE . 34.3 mt -146.44 165.41 8.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 114.84 -1.073 . . . . 0.0 110.589 179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.067 HG12 ' HB2' ' B' ' 39' ' ' ALA . 1.7 p -155.14 122.35 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.983 0.421 . . . . 0.0 111.596 -179.368 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.629 ' HA2' ' OE2' ' B' ' 35' ' ' GLU . . . -149.2 -175.02 21.23 Favored Glycine 0 N--CA 1.449 -0.5 0 CA-C-N 115.804 -0.635 . . . . 0.0 112.037 179.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.646 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.9 OUTLIER -146.3 36.18 1.0 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.711 0.291 . . . . 0.0 111.218 -179.804 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.646 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.2 OUTLIER 168.11 26.6 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.121 179.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.8 ' CE2' ' HB3' ' B' ' 64' ' ' SER . 0.1 OUTLIER -111.48 -166.57 1.09 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 179.797 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.674 ' HA3' ' N ' ' A' ' 36' ' ' LYS . . . -144.8 77.79 0.27 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 121.093 -0.575 . . . . 0.0 111.843 179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 1.006 ' HB2' HD12 ' A' ' 57' ' ' ILE . 18.1 p -70.6 131.77 44.45 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.034 0.445 . . . . 0.0 111.531 -179.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.821 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 55.7 t80 -144.76 76.51 1.5 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.304 179.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 1.013 HG13 HD11 ' A' ' 57' ' ' ILE . 28.5 m -110.2 167.39 4.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.235 -179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.594 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 28.7 m -112.8 134.98 54.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.875 -179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.6 ' HD2' ' HB3' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -87.36 176.63 7.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.834 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.631 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -162.61 56.81 0.22 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.827 -179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.697 HG23 ' H ' ' B' ' 71' ' ' LYS . 2.0 t 169.37 -108.04 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.947 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.697 ' H ' HG23 ' B' ' 70' ' ' THR . 0.0 OUTLIER -163.26 28.94 0.09 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.606 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.965 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 7.3 m80 -128.75 41.96 3.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.983 -179.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.767 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 12.9 t80 -117.59 83.65 2.03 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.357 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.877 HD11 HD11 ' B' ' 8' ' ' ILE . 0.0 OUTLIER -110.94 109.5 28.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.922 -179.155 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.906 ' HB3' ' HB3' ' B' ' 10' ' ' ASN . 14.1 t80 -99.33 126.02 45.1 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.315 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.954 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.7 p90 -142.92 170.24 16.06 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.007 -179.732 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.659 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 50.9 t80 -132.9 116.94 17.09 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.621 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.039 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -69.13 167.64 15.68 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.679 -179.871 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.476 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -29.12 -46.9 0.08 OUTLIER Glycine 0 C--N 1.329 0.145 0 C-N-CA 120.946 -0.645 . . . . 0.0 112.945 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -143.32 27.63 1.55 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.845 0.355 . . . . 0.0 110.982 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.684 HG12 ' N ' ' B' ' 82' ' ' ALA . 38.3 t -145.41 171.03 5.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.894 -179.871 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.844 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -132.34 145.52 51.31 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.464 -0.334 . . . . 0.0 110.882 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.844 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -142.97 106.42 1.2 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.153 -179.741 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.787 HD23 ' HB ' ' B' ' 57' ' ' ILE . 0.2 OUTLIER -97.97 110.17 22.8 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.575 179.741 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.992 HD12 ' HB2' ' B' ' 56' ' ' CYS . 2.0 mp -106.88 125.21 50.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.9 -179.772 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.723 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 0.7 OUTLIER -151.58 119.07 6.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.364 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.965 ' HB2' ' HB2' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -97.01 164.27 12.59 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.758 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.631 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -119.23 18.98 12.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.341 0.591 . . . . 0.0 110.649 179.918 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . 0.482 ' HA2' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.339 -1.256 . . . . 0.0 112.467 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.427 ' O ' ' CG ' ' A' ' 1' ' ' MET . 1.4 ttp . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.879 0.371 . . . . 0.0 111.079 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 m -102.82 42.33 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.954 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -113.9 165.83 12.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.941 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.51 ' HD2' ' HB2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -112.74 78.69 1.15 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.022 -179.842 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.787 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -64.58 110.21 2.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.75 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.049 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 159.15 172.78 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.693 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.777 ' O ' ' HE2' ' A' ' 9' ' ' LYS . 8.7 t -131.03 69.37 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.2 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.924 HD11 HD11 ' A' ' 74' ' ' ILE . 0.9 OUTLIER -33.48 149.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.625 179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.777 ' HE2' ' O ' ' A' ' 7' ' ' VAL . 0.1 OUTLIER -134.84 -12.71 2.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.8 -179.922 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 177.51 93.69 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.638 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.78 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -129.72 104.13 7.24 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.723 -179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.54 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 16.8 m-20 -96.01 27.71 3.48 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.234 0.54 . . . . 0.0 109.866 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.919 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.9 OUTLIER -103.79 168.96 8.8 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.448 -0.796 . . . . 0.0 110.783 -179.622 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.902 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -51.32 123.59 9.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.954 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.466 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -34.86 -69.36 0.1 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.824 179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.525 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 32.6 tt0 -52.15 -28.38 17.79 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.558 179.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.919 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -71.85 -41.6 67.93 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.856 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.738 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.42 -29.51 69.02 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 120.944 0.402 . . . . 0.0 110.331 179.529 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.759 ' HG3' ' N ' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -77.21 -42.32 37.87 Favored 'General case' 0 C--N 1.331 -0.223 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.097 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.759 ' N ' ' HG3' ' A' ' 19' ' ' GLN . 0.4 OUTLIER -69.29 -28.4 66.25 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 115.452 -0.794 . . . . 0.0 109.555 178.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.887 ' OG ' HD22 ' A' ' 85' ' ' LEU . 30.0 t -67.11 -51.12 58.07 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.969 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.777 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 94.1 t -54.41 -46.59 70.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.926 179.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -54.34 -43.62 71.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.351 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -62.04 -39.27 91.76 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 116.07 -0.514 . . . . 0.0 109.951 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.731 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -69.39 -30.97 69.07 Favored 'General case' 0 CA--C 1.513 -0.454 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.3 OUTLIER -70.68 -37.08 73.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.58 178.499 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.43 HE21 ' HB3' ' A' ' 27' ' ' GLN . 6.0 mt-30 -58.81 -42.4 89.09 Favored 'General case' 0 N--CA 1.454 -0.249 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 178.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.928 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -79.84 -23.03 42.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.289 178.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.731 HD12 ' O ' ' A' ' 25' ' ' ALA . 4.6 mt -81.1 -26.13 36.45 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.022 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -92.23 -32.47 15.05 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.201 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.533 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -86.08 -24.94 26.11 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.783 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.628 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -150.11 155.86 40.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.614 179.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.413 ' HA ' HD11 ' A' ' 38' ' ' ILE . 0.0 OUTLIER -123.54 28.53 6.96 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.063 0.458 . . . . 0.0 110.735 179.846 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.88 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 16.1 mm -106.59 107.54 22.96 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.942 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.774 ' HB3' ' CA ' ' B' ' 63' ' ' GLY . 0.9 OUTLIER -26.67 -84.94 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.033 -179.97 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -40.01 -47.31 2.25 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.323 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.88 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -54.75 -63.11 1.26 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.854 0.359 . . . . 0.0 111.14 -179.652 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.928 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 3.2 mt -48.2 -48.21 13.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.287 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.937 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.86 -42.1 92.94 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.05 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.797 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.4 -64.67 0.77 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.077 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.685 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -52.29 -39.53 60.63 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.659 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.778 ' CG2' HD11 ' A' ' 85' ' ' LEU . 85.4 mt -58.56 -57.22 11.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.958 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.525 ' HZ2' ' HE2' ' B' ' 65' ' ' TYR . 0.2 OUTLIER -51.57 -60.51 3.07 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.74 179.931 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -42.57 -62.23 1.03 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.835 179.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.602 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.3 mt-10 -42.98 -67.48 0.27 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.946 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.813 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -44.57 -51.32 9.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.083 -179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.723 ' OD1' ' HB2' ' A' ' 54' ' ' TRP . 0.6 OUTLIER -57.54 -25.02 59.27 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.087 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 3.1 mmmt -120.97 14.27 11.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.18 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.602 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.5 tttp -128.44 1.89 5.64 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.389 -179.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.523 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 72.2 m-85 -152.85 -62.13 0.15 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.185 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.482 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 3.1 m-20 161.24 117.67 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.566 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.583 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 19.1 Cg_endo -60.06 169.18 5.07 Favored 'Trans proline' 0 CA--C 1.533 0.431 0 C-N-CA 122.521 2.147 . . . . 0.0 112.327 -179.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.784 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 88.6 m -104.92 130.58 53.06 Favored 'General case' 0 C--N 1.345 0.374 0 C-N-CA 123.011 0.525 . . . . 0.0 110.254 -0.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.723 ' HB2' ' OD1' ' A' ' 47' ' ' ASP . 69.1 m95 -101.51 170.56 8.12 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.654 0.74 . . . . 0.0 112.421 -178.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.624 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.3 OUTLIER -162.92 103.64 1.01 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.507 -1.224 . . . . 0.0 108.442 179.495 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.965 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -117.97 156.12 29.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.538 0.685 . . . . 0.0 112.796 -177.667 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.951 ' CG1' HD23 ' A' ' 84' ' ' LEU . 27.0 mm -127.45 157.52 39.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.144 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.937 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.1 p -152.36 112.12 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.888 0.375 . . . . 0.0 111.276 179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.502 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -150.75 -155.86 7.09 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.157 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.49 ' HB2' HH11 ' A' ' 60' ' ' ARG . 0.1 OUTLIER -163.5 34.72 0.09 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 120.76 0.314 . . . . 0.0 111.289 -179.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.455 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 171.05 26.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.812 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.787 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 24.0 p90 -111.12 179.95 3.9 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.802 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.873 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -135.4 96.29 0.27 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.321 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.905 ' CA ' HD12 ' B' ' 57' ' ' ILE . 4.7 p -82.03 129.82 34.9 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.061 0.458 . . . . 0.0 111.54 -179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.803 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 67.3 t80 -143.49 84.18 1.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.118 179.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.882 HG13 HD11 ' B' ' 57' ' ' ILE . 4.4 m -135.81 159.85 39.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.306 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.821 HG22 ' CE1' ' B' ' 55' ' ' HIS . 1.3 t -66.75 -171.98 0.16 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.034 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.623 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -129.05 172.69 11.15 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.011 -179.879 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.738 ' CG ' ' HA ' ' A' ' 88' ' ' SER . 7.1 mm-40 -163.85 143.85 8.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.885 179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.707 HG21 ' NZ ' ' A' ' 87' ' ' LYS . 48.3 m 47.64 -102.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.801 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.797 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 19.6 mmtt -74.06 32.9 0.08 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.742 179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.752 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 53.7 m-70 48.77 -87.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.802 -179.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.752 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 2.3 p90 163.51 156.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.786 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.924 HD11 HD11 ' A' ' 8' ' ' ILE . 0.7 OUTLIER -127.96 106.21 14.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.118 0.485 . . . . 0.0 111.024 179.566 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.743 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 63.4 t80 -106.72 93.82 4.78 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.468 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.856 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -107.69 168.59 9.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.331 -179.534 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.897 ' HD1' ' HB2' ' A' ' 82' ' ' ALA . 76.7 t80 -127.0 87.39 2.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.716 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.049 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -40.67 167.9 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.919 179.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.465 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.38 -48.58 0.33 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.759 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -139.25 20.6 2.59 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.827 0.346 . . . . 0.0 111.084 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.743 HG12 ' N ' ' A' ' 82' ' ' ALA . 39.9 t -140.7 175.12 6.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.879 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.897 ' HB2' ' HD1' ' A' ' 77' ' ' TYR . . . -137.14 143.45 42.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.661 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.666 ' HA ' ' O ' ' A' ' 57' ' ' ILE . 0.2 OUTLIER -132.45 111.49 17.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.161 -179.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.951 HD23 ' CG1' ' A' ' 57' ' ' ILE . 3.9 tp -94.93 88.81 5.4 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.417 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.965 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -93.65 141.0 28.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.458 -179.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.699 ' HB3' ' HB2' ' A' ' 73' ' ' PHE . 2.8 p90 -176.51 152.23 1.03 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.629 179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.797 ' HZ3' ' HG2' ' A' ' 71' ' ' LYS . 0.7 OUTLIER -112.43 -168.46 1.32 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.841 179.88 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.738 ' HA ' ' CG ' ' A' ' 69' ' ' GLU . 41.8 m -145.21 18.26 1.56 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.297 0.57 . . . . 0.0 110.517 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.37 -1.239 . . . . 0.0 112.434 -179.974 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.423 ' HB3' ' H ' ' B' ' 2' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.87 0.367 . . . . 0.0 111.045 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.525 ' O ' ' HB2' ' B' ' 3' ' ' ASP . 0.5 OUTLIER -63.04 -19.26 64.21 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.833 179.793 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.645 ' HB3' ' CD ' ' B' ' 23' ' ' GLU . 16.2 m-20 80.26 173.65 0.13 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.91 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.444 ' NH1' ' HB2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER 63.78 -79.26 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.89 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.497 ' C ' HD13 ' B' ' 78' ' ' LEU . 0.8 OUTLIER 46.08 31.01 1.04 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.002 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.008 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.79 -177.94 4.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.27 -179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.904 HG12 ' HE2' ' B' ' 9' ' ' LYS . 72.9 t -141.85 68.84 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.553 179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.884 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.4 OUTLIER -38.58 150.34 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 -179.725 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.904 ' HE2' HG12 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -137.92 -15.51 1.33 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.991 179.497 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.586 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.5 OUTLIER -175.92 122.73 0.19 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.417 -179.864 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.623 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -149.03 102.08 3.22 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.788 0.328 . . . . 0.0 111.821 -179.742 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.775 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -84.62 26.79 0.77 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.291 0.567 . . . . 0.0 109.857 178.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.876 ' HG2' ' N ' ' B' ' 14' ' ' SER . 0.1 OUTLIER -114.66 166.76 11.39 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.544 -179.586 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.876 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.3 OUTLIER -55.33 141.37 36.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.744 179.848 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.653 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -51.58 -56.59 12.65 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.862 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -28.73 63.38 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.686 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.751 ' HA ' ' OD2' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -75.56 -39.51 58.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.851 179.85 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.974 ' O ' HG23 ' B' ' 22' ' ' VAL . 0.0 OUTLIER -66.42 -29.25 69.35 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.052 -179.817 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -77.55 -45.15 26.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.095 0.474 . . . . 0.0 109.818 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.751 ' OD2' ' HA ' ' B' ' 17' ' ' MET . 2.2 p30 -70.97 -27.72 63.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.741 179.095 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.787 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 96.2 p -68.88 -44.27 73.63 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.232 179.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.974 HG23 ' O ' ' B' ' 18' ' ' GLN . 40.6 t -62.67 -47.32 93.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.564 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.645 ' CD ' ' HB3' ' B' ' 3' ' ' ASP . 3.6 mm-40 -58.73 -35.05 72.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.047 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -68.69 -37.24 79.39 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.006 179.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.728 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -70.08 -31.14 68.57 Favored 'General case' 0 CA--C 1.511 -0.546 0 N-CA-C 108.328 -0.99 . . . . 0.0 108.328 178.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.7 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 23.8 m -71.0 -42.34 69.73 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.295 -1.321 . . . . 0.0 109.505 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.545 ' O ' ' HG3' ' B' ' 30' ' ' GLU . 1.7 mt-30 -51.97 -46.44 64.8 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.316 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.828 ' HB3' HG23 ' B' ' 38' ' ' ILE . . . -77.24 -19.83 56.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.172 178.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.837 HD11 HD11 ' B' ' 83' ' ' ILE . 5.2 mt -78.71 -25.22 44.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.938 179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.545 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 1.2 pt-20 -90.28 -38.39 13.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.172 -179.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.858 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.2 mmtp -77.52 -33.48 54.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.614 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.858 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -143.4 146.38 33.43 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.812 -179.849 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.506 ' OD1' HD13 ' B' ' 34' ' ' ILE . 26.2 p30 -113.52 30.22 7.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.126 -179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.925 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 14.6 mm -106.78 105.98 19.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.676 179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.873 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.3 mp0 -29.52 -67.48 0.08 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.992 -179.71 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.605 ' HD3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -52.71 -56.96 11.81 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.886 0.374 . . . . 0.0 110.719 179.625 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.925 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.7 t0 -45.55 -65.43 0.54 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.743 179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.828 HG23 ' HB3' ' B' ' 28' ' ' ALA . 8.2 mt -43.76 -58.94 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.114 -179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 1.035 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -45.96 -52.83 11.02 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.952 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.803 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -47.84 -66.11 0.46 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.967 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.58 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -45.86 -43.64 13.72 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.942 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.728 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 67.1 mt -54.85 -62.84 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.047 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.79 ' HB3' ' CE2' ' A' ' 65' ' ' TYR . 12.0 tttm -50.48 -37.28 37.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.752 179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' B' ' 48' ' ' LYS . 0.3 OUTLIER -64.2 -46.99 81.48 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.093 -179.811 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.726 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 26.3 tt0 -73.25 -28.83 62.36 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.057 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.787 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -77.49 -36.17 52.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.886 -179.963 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.768 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 4.0 m-20 -74.92 -30.49 61.27 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.098 0.475 . . . . 0.0 110.221 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.427 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -87.08 -40.78 14.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.753 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.726 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.9 ttmt -76.6 -27.34 55.75 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.168 -179.553 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.556 ' CD2' ' HE1' ' B' ' 17' ' ' MET . 16.7 m-85 -121.02 -68.52 0.9 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.339 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.497 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER 155.86 119.47 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.188 0 CA-C-N 115.766 -0.652 . . . . 0.0 109.703 -179.523 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.768 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 19.7 Cg_endo -58.53 168.31 4.16 Favored 'Trans proline' 0 CA--C 1.533 0.46 0 C-N-CA 122.375 2.05 . . . . 0.0 112.645 -179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.623 HG21 HG21 ' A' ' 67' ' ' THR . 15.1 t -106.91 133.16 51.99 Favored 'General case' 0 C--N 1.343 0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 111.229 0.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.89 ' NE1' ' HE3' ' B' ' 87' ' ' LYS . 39.5 m95 -103.86 110.14 22.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.418 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.821 ' CE1' HG22 ' A' ' 67' ' ' THR . 3.5 m170 -82.57 95.62 7.82 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.678 ' O ' HD13 ' B' ' 57' ' ' ILE . 24.5 p -110.43 133.93 52.81 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.949 ' CG1' HD23 ' B' ' 84' ' ' LEU . 17.6 mm -125.15 115.23 43.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.309 -0.86 . . . . 0.0 109.704 178.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.035 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -116.87 119.13 61.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 121.024 0.44 . . . . 0.0 111.691 -179.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.805 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -137.17 -125.98 2.47 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.957 -0.64 . . . . 0.0 111.809 179.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 61' ' ' ASN . 0.7 OUTLIER -165.15 -6.1 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 120.671 0.272 . . . . 0.0 111.464 -179.91 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.443 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 14.2 t-20 179.26 37.14 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.856 0.36 . . . . 0.0 111.077 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.787 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.4 p90 -88.62 179.85 6.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.94 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.774 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -125.28 74.98 0.4 Allowed Glycine 0 N--CA 1.453 -0.232 0 C-N-CA 120.947 -0.644 . . . . 0.0 111.981 179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.866 ' HA ' HG23 ' A' ' 57' ' ' ILE . 65.4 p -71.26 135.26 47.36 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.965 0.412 . . . . 0.0 111.514 -179.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.877 ' H ' HD13 ' A' ' 57' ' ' ILE . 18.4 t80 -146.83 71.16 1.22 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.458 179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.854 HG21 ' CD2' ' B' ' 86' ' ' PHE . 17.9 m -104.59 163.73 4.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.097 -179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.617 ' H ' ' HD1' ' A' ' 55' ' ' HIS . 20.0 m -103.02 103.94 14.08 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.15 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.545 ' HD2' ' CB ' ' B' ' 12' ' ' ASP . 0.0 OUTLIER -70.74 -158.36 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.843 179.841 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.535 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.4 OUTLIER 177.33 -87.07 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.056 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.5 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 2.0 m -37.97 -99.2 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.281 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.599 ' NZ ' ' HB3' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 179.16 44.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.903 -179.78 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.698 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 36.6 m80 -135.48 42.52 2.69 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.877 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.775 ' HD1' ' H ' ' B' ' 12' ' ' ASP . 2.7 t80 -113.6 106.83 14.99 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.419 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.837 HG23 ' HE1' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -121.81 144.83 29.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.641 -179.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.817 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -133.95 133.35 41.28 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.006 179.175 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.884 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.08 163.55 36.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.933 0.397 . . . . 0.0 111.577 -179.344 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.684 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 11.5 t80 -120.79 105.25 10.56 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.737 179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.008 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.3 mm? -69.86 170.77 10.46 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.605 179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.499 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.73 -35.6 0.01 OUTLIER Glycine 0 C--N 1.33 0.222 0 C-N-CA 120.982 -0.628 . . . . 0.0 112.898 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.599 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -159.54 43.41 0.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.787 0.327 . . . . 0.0 110.854 179.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.805 HG13 ' O ' ' B' ' 59' ' ' GLY . 54.2 t -158.92 167.1 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.235 -179.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.614 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -140.8 101.14 4.0 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.707 179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.837 HD11 HD11 ' B' ' 29' ' ' LEU . 0.3 OUTLIER -84.61 150.06 4.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.374 -179.64 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.949 HD23 ' CG1' ' B' ' 57' ' ' ILE . 1.6 tp -135.64 84.88 2.12 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.971 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.716 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.4 OUTLIER -87.91 137.46 32.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.929 0.395 . . . . 0.0 110.948 179.816 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.854 ' CD2' HG21 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -171.64 124.23 0.56 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.897 179.765 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.89 ' HE3' ' NE1' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -96.62 149.35 21.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.829 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.799 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -109.97 20.41 17.99 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.302 0.572 . . . . 0.0 110.566 179.809 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.429 -1.206 . . . . 0.0 112.508 -179.987 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.768 0.318 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.56 ' O ' ' HG2' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -122.78 77.41 1.44 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.95 179.996 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 42.09 32.31 0.3 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.061 179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 2' ' ' CYS . 1.9 mtm180 -86.03 -49.75 7.57 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.934 0.397 . . . . 0.0 110.715 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.422 ' C ' ' O ' ' A' ' 4' ' ' ARG . 0.7 OUTLIER 33.54 31.51 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.378 179.896 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.097 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.18 -169.61 2.1 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.217 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 77' ' ' TYR . 15.1 t -147.89 72.47 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.87 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.806 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.9 135.82 0.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-O 121.029 0.442 . . . . 0.0 110.355 179.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.435 ' HE3' HG12 ' A' ' 7' ' ' VAL . 8.5 mmpt? -113.59 -18.59 11.89 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.544 -179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.64 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 0.7 OUTLIER -176.06 158.62 2.02 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.682 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 169.03 138.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.998 0.427 . . . . 0.0 111.685 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.791 ' HB3' ' CG ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER -123.65 28.96 6.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.464 179.461 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.728 ' HG3' ' H ' ' A' ' 14' ' ' SER . 15.8 ttp -104.44 170.44 7.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.842 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.728 ' H ' ' HG3' ' A' ' 13' ' ' MET . 22.7 t -56.41 129.35 40.24 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.699 179.761 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.667 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.0 mm-40 -36.72 -67.57 0.17 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.873 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -48.58 -29.51 4.35 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.802 179.874 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.652 ' CB ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -74.54 -31.91 62.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.791 179.799 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.979 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -72.83 -39.07 66.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.586 179.751 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.609 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 93.0 mt-30 -77.46 -34.09 54.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.763 179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.457 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.0 OUTLIER -71.49 -36.25 71.07 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.603 179.12 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.999 ' HB2' HD22 ' A' ' 85' ' ' LEU . 1.2 p -64.34 -50.15 68.88 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.699 -0.682 . . . . 0.0 109.942 179.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.954 HG23 ' O ' ' A' ' 18' ' ' GLN . 16.4 t -54.98 -45.15 76.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.338 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.673 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 11.8 mt-10 -56.07 -41.05 74.5 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.35 179.503 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 1.8 t -62.63 -39.44 93.85 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.141 0.496 . . . . 0.0 110.027 179.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.769 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.22 -30.89 69.15 Favored 'General case' 0 CA--C 1.513 -0.476 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.543 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -70.75 -36.95 73.37 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 114.627 -1.17 . . . . 0.0 109.498 178.543 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.673 ' HG3' ' O ' ' A' ' 23' ' ' GLU . 22.2 mt-30 -59.52 -41.62 90.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.478 178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.927 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -83.04 -22.57 33.5 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.688 179.224 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.737 HD12 ' C ' ' A' ' 25' ' ' ALA . 4.3 mt -76.28 -36.13 58.55 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.992 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -89.08 -29.65 19.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.837 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.667 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 20.6 mttt -83.63 -20.84 32.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.614 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.627 ' CG ' ' HE1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -146.31 -172.52 3.96 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.586 179.728 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -156.09 27.48 0.36 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.103 0.478 . . . . 0.0 110.542 179.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.064 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 18.9 mm -114.57 104.64 17.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.772 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 3.5 mp0 -25.39 -77.02 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.393 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.501 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -46.17 -45.14 16.51 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.193 -179.928 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 1.064 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -57.97 -60.14 4.18 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.936 -179.986 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.927 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 4.3 mt -51.75 -54.78 11.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.985 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 1.041 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -53.78 -39.38 65.37 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.043 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.754 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.9 -63.12 1.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.123 -179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.692 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -54.76 -49.03 71.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.822 -179.926 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.822 ' CG2' HD11 ' A' ' 85' ' ' LEU . 73.3 mt -44.39 -58.85 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.091 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.736 ' HE3' ' CE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -60.26 -61.61 2.47 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.682 179.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.569 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 10.6 mttt -36.71 -66.31 0.23 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.004 179.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.751 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 2.3 mm-40 -49.16 -42.6 40.21 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.91 -179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -61.9 -42.71 99.4 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.165 -179.921 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.733 ' HA ' ' CD1' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -65.55 -24.11 67.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.845 -179.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.92 8.92 16.03 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.461 -179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.751 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 7.4 tttm -118.17 -1.52 11.35 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 111.654 0.242 . . . . 0.0 111.654 -179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.718 ' CE1' ' HB3' ' A' ' 49' ' ' LYS . 10.9 m-85 -150.52 -62.64 0.2 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.828 0.347 . . . . 0.0 111.363 -179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.695 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 17.3 t-20 164.82 115.46 0.02 OUTLIER Pre-proline 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.291 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.723 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 18.9 Cg_endo -60.03 168.82 5.45 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 122.339 2.026 . . . . 0.0 112.593 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.789 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.9 m -101.82 137.34 40.25 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 122.757 0.423 . . . . 0.0 110.3 0.032 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.84 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 76.5 m95 -106.12 140.42 39.12 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.517 0.675 . . . . 0.0 112.039 -179.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.883 ' HE2' ' HB2' ' A' ' 88' ' ' SER . 0.4 OUTLIER -132.18 107.82 8.86 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.923 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 1.027 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -127.87 175.08 8.62 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.388 0.614 . . . . 0.0 112.198 -177.922 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.922 HG12 ' HA ' ' B' ' 64' ' ' SER . 60.8 mt -155.39 165.1 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 115.009 -0.996 . . . . 0.0 110.713 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.041 HG12 ' HB2' ' A' ' 39' ' ' ALA . 7.5 p -151.55 119.32 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-O 120.942 0.401 . . . . 0.0 110.984 -179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.479 ' O ' ' N ' ' A' ' 82' ' ' ALA . . . -143.91 -174.49 16.22 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.113 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.802 ' HG3' HH11 ' A' ' 60' ' ' ARG . 0.4 OUTLIER -150.88 30.06 0.65 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.825 0.345 . . . . 0.0 111.014 -179.646 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.694 ' ND2' ' NH1' ' B' ' 60' ' ' ARG . 0.7 OUTLIER 172.14 27.5 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.91 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.793 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -111.07 -168.21 1.27 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.738 179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -142.13 78.59 0.28 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.855 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.807 ' HA ' HG23 ' B' ' 57' ' ' ILE . 5.8 p -72.23 128.54 35.97 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.992 0.425 . . . . 0.0 111.231 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.871 ' H ' HD13 ' B' ' 57' ' ' ILE . 33.0 t80 -143.45 83.59 1.78 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.415 179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.014 HG13 HD11 ' B' ' 57' ' ' ILE . 2.9 m -127.42 155.85 38.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.453 -179.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.825 HG22 ' NE2' ' B' ' 55' ' ' HIS . 1.2 t -63.75 -157.94 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.488 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.804 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -148.02 112.76 5.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.847 0.356 . . . . 0.0 111.198 179.923 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.738 ' CB ' ' HA ' ' A' ' 88' ' ' SER . 38.9 mm-40 -97.43 174.08 6.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.747 179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.547 ' C ' ' H ' ' A' ' 72' ' ' HIS . 0.2 OUTLIER 38.02 -119.19 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.688 -179.824 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.43 ' H ' ' HB ' ' A' ' 70' ' ' THR . 3.1 mttt -71.16 30.98 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.904 0.383 . . . . 0.0 110.832 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.804 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 15.5 m-70 68.91 -88.48 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.008 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.793 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 162.55 -163.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.752 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.979 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.2 OUTLIER -169.64 111.07 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.617 179.515 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.445 ' CE1' ' OG ' ' A' ' 64' ' ' SER . 40.0 t80 -105.38 129.21 53.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.309 179.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.806 ' HB3' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -141.77 178.73 7.29 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.959 0.409 . . . . 0.0 111.203 -179.849 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.847 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 5.3 t80 -140.18 102.75 4.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.752 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.097 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.6 OUTLIER -67.88 -176.0 0.62 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.922 0.391 . . . . 0.0 111.043 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.545 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -55.82 88.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.768 -0.729 . . . . 0.0 112.278 179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.631 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 2.5 mp0 80.07 10.64 1.23 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.777 0.322 . . . . 0.0 110.863 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.838 HG12 ' H ' ' A' ' 82' ' ' ALA . 4.4 t -136.22 177.49 6.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.248 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.969 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -148.55 159.7 43.81 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.888 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.969 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.5 OUTLIER -146.21 117.23 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 CA-C-O 120.915 0.388 . . . . 0.0 111.707 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.948 HD21 ' HE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -99.64 100.02 10.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.301 179.319 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 1.027 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.5 OUTLIER -103.2 130.98 50.56 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 -179.308 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.948 ' HE2' HD21 ' A' ' 84' ' ' LEU . 34.3 p90 -166.89 131.79 2.08 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.773 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.84 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 34.6 mtpt -86.2 -163.2 0.85 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.837 179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.883 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 2.8 m -147.72 17.44 1.14 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.372 0.606 . . . . 0.0 110.366 179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.401 ' N ' ' OG1' ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.353 -1.249 . . . . 0.0 112.531 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 8.0 tpt . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.699 0.285 . . . . 0.0 111.244 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.476 ' SG ' ' HB3' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -155.53 125.2 6.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.909 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.596 ' O ' ' HG2' ' B' ' 23' ' ' GLU . 0.1 OUTLIER -104.79 142.99 33.73 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.661 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.832 ' N ' ' HD2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -112.84 -21.96 10.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.912 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.632 ' HA ' ' CE ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 42.61 28.06 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.599 -179.822 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.097 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -126.15 -164.71 1.35 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.932 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.534 HG23 ' O ' ' B' ' 77' ' ' TYR . 14.7 t -151.5 75.54 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.126 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.904 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -40.11 156.21 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.59 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.642 ' HE3' ' HB3' ' B' ' 77' ' ' TYR . 0.0 OUTLIER -151.9 -8.84 0.21 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.526 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.589 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 0.1 OUTLIER -164.58 73.59 0.24 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.459 179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.76 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -118.04 113.37 21.55 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.485 -179.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.708 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 1.4 m-20 -114.29 32.58 5.83 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.379 179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.887 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.0 OUTLIER -116.65 170.02 8.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.677 -179.68 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.882 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -49.32 129.59 18.64 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.855 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.627 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 47.8 mt-10 -38.32 -70.43 0.1 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.035 -179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.483 ' H ' ' HG2' ' B' ' 16' ' ' GLU . 3.3 mm-40 -48.64 -31.99 7.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.902 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.887 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -69.97 -38.59 76.12 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.794 179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.883 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -67.31 -38.43 84.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.746 179.911 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.747 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 7.3 mm-40 -73.92 -35.83 64.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.772 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.612 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.5 OUTLIER -72.46 -30.81 64.91 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-N 115.707 -0.679 . . . . 0.0 109.806 179.189 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.794 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.4 OUTLIER -68.61 -42.36 78.23 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.294 179.487 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.827 HG23 ' O ' ' B' ' 18' ' ' GLN . 12.5 t -66.95 -38.04 80.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.438 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.747 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 18.8 mt-10 -63.78 -39.11 93.46 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.081 179.307 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 73.0 m -68.72 -34.25 75.31 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.972 -0.558 . . . . 0.0 109.915 179.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.844 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -73.14 -33.77 65.69 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 178.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.761 ' HA ' HD12 ' B' ' 29' ' ' LEU . 53.8 m -70.53 -38.43 74.23 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-N 114.615 -1.175 . . . . 0.0 109.296 178.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.407 ' HB3' ' CE1' ' B' ' 41' ' ' HIS . 10.7 mt-30 -58.52 -42.06 86.86 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.356 178.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.922 ' HB2' ' CD2' ' B' ' 41' ' ' HIS . . . -67.67 -35.85 79.62 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.133 178.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.844 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.1 mt -64.1 -38.86 92.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.802 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.64 -30.62 59.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.175 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.545 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 1.0 OUTLIER -82.93 -29.48 29.11 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.875 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.564 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -149.75 169.04 21.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.629 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.694 ' C ' HD13 ' B' ' 34' ' ' ILE . 11.3 t30 -129.09 30.51 5.02 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.124 -179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 1.021 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.8 mm -116.73 106.29 19.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.049 179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.918 ' HA ' HD12 ' B' ' 38' ' ' ILE . 1.1 mp0 -29.61 -70.35 0.05 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.769 0.318 . . . . 0.0 110.667 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.402 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -44.12 -43.95 7.3 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.589 179.421 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 1.021 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.2 OUTLIER -64.06 -59.56 4.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.451 179.634 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 1.026 ' HB ' HG11 ' B' ' 58' ' ' VAL . 1.0 OUTLIER -45.35 -53.74 1.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.665 179.559 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.956 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.83 -49.11 50.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.477 179.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.821 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -53.86 -68.23 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.473 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.922 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.2 OUTLIER -37.59 -40.92 0.43 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.45 179.343 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.873 HG21 HD11 ' B' ' 85' ' ' LEU . 56.9 mt -68.15 -67.66 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.555 -179.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.674 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 6.0 tttp -39.87 -53.42 2.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.267 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.641 ' HE2' ' OH ' ' A' ' 65' ' ' TYR . 23.7 mttm -60.33 -43.98 95.92 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.415 -179.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.77 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 50.0 tp10 -62.12 -37.2 84.22 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.296 -179.605 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.794 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.36 -34.95 73.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.118 -179.842 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.726 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.3 OUTLIER -68.73 -35.49 77.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.807 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -89.58 -23.52 21.95 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.138 -179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.77 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.97 -26.43 21.51 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.038 -179.809 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.643 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 1.4 m-85 -127.94 -62.45 1.06 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.171 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.686 HD22 ' N ' ' B' ' 51' ' ' ASN . 0.0 OUTLIER 154.96 117.12 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.828 -179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.726 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 10.8 Cg_endo -53.92 169.45 0.61 Allowed 'Trans proline' 0 CA--C 1.531 0.372 0 C-N-CA 122.351 2.034 . . . . 0.0 112.191 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.589 HG21 ' HB ' ' A' ' 67' ' ' THR . 5.8 m -111.37 124.92 53.24 Favored 'General case' 0 C--N 1.342 0.278 0 C-N-CA 122.866 0.467 . . . . 0.0 110.705 0.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.678 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 33.6 m95 -97.53 146.75 24.95 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.723 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.825 ' NE2' HG22 ' A' ' 67' ' ' THR . 10.5 m170 -111.07 98.79 7.79 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.108 178.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.626 ' O ' ' HB1' ' B' ' 39' ' ' ALA . 43.6 t -103.58 124.05 48.08 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.798 0.666 . . . . 0.0 112.798 -177.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 1.014 HD11 HG13 ' A' ' 66' ' ' VAL . 21.2 mm -121.92 102.54 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.127 178.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.026 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.6 p -107.24 121.87 60.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.678 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.733 ' O ' ' HB3' ' B' ' 60' ' ' ARG . . . -146.64 -97.24 0.2 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.05 -0.595 . . . . 0.0 111.773 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.733 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 7.8 ptt180 167.59 -27.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.452 0 N-CA-C 111.633 0.234 . . . . 0.0 111.633 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -158.6 46.69 0.32 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.667 0.27 . . . . 0.0 111.407 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.793 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 14.8 p90 -96.37 175.41 6.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.659 179.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.646 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -117.0 83.94 0.36 Allowed Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.844 -0.693 . . . . 0.0 111.947 179.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.922 ' HA ' HG12 ' A' ' 57' ' ' ILE . 0.3 OUTLIER -75.73 133.12 40.83 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.087 0.47 . . . . 0.0 111.432 -179.395 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.868 ' H ' HG12 ' A' ' 57' ' ' ILE . 22.4 t80 -142.45 61.08 1.44 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.762 -0.653 . . . . 0.0 110.199 179.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.774 ' HB ' ' CZ ' ' B' ' 86' ' ' PHE . 33.2 m -108.6 168.65 3.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.678 -179.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.515 ' O ' ' CE1' ' A' ' 55' ' ' HIS . 81.8 m -130.72 107.7 9.35 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.93 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.805 ' CE1' ' HG3' ' B' ' 87' ' ' LYS . 2.3 t-80 -63.92 -143.11 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.204 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.644 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER 171.21 15.11 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.668 -179.915 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.899 HG21 ' NZ ' ' B' ' 87' ' ' LYS . 98.0 m -141.97 -96.92 0.13 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.082 -179.822 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.846 ' HG2' ' HG3' ' B' ' 13' ' ' MET . 0.0 OUTLIER -87.31 14.69 7.43 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.268 -179.723 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.708 ' CG ' ' HB3' ' B' ' 12' ' ' ASP . 47.7 m80 76.99 -78.84 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.917 179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.722 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 12.4 p90 156.5 -169.98 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.34 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.929 HG23 ' HE1' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -157.35 114.11 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.021 0.439 . . . . 0.0 111.617 179.804 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.616 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 0.1 OUTLIER -102.27 137.24 40.79 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.236 179.435 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.929 ' HE1' HG23 ' B' ' 74' ' ' ILE . 0.4 OUTLIER -160.64 159.22 30.12 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.916 0.389 . . . . 0.0 111.307 -179.821 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.642 ' HB3' ' HE3' ' B' ' 9' ' ' LYS . 7.8 t80 -125.07 112.59 16.7 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.964 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.097 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -71.65 170.5 13.33 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.489 179.553 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.543 ' O ' ' HG3' ' B' ' 80' ' ' GLN . . . -24.44 -40.18 0.01 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 121.211 -0.518 . . . . 0.0 113.037 -179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' B' ' 78' ' ' LEU . 27.2 mt-30 -157.56 40.1 0.29 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.867 0.365 . . . . 0.0 110.803 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.729 HG13 ' O ' ' B' ' 59' ' ' GLY . 98.6 t -154.73 169.74 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.123 -179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.842 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -132.36 151.96 51.64 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.331 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.842 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.2 OUTLIER -140.09 134.55 36.49 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-O 121.076 0.465 . . . . 0.0 111.589 -179.671 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.938 HD23 ' CG1' ' B' ' 57' ' ' ILE . 0.3 OUTLIER -123.84 97.61 5.44 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.108 179.552 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.873 HD11 HG21 ' B' ' 42' ' ' ILE . 0.5 OUTLIER -100.85 131.62 46.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.975 0.417 . . . . 0.0 111.541 -179.118 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.774 ' CZ ' ' HB ' ' B' ' 66' ' ' VAL . 0.4 OUTLIER -172.34 123.97 0.49 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.586 179.701 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.899 ' NZ ' HG21 ' B' ' 70' ' ' THR . 0.0 OUTLIER -82.29 161.82 22.5 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.779 0.323 . . . . 0.0 110.721 179.958 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.687 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -107.57 19.12 20.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.231 0.538 . . . . 0.0 110.767 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . 0.473 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.427 -1.207 . . . . 0.0 112.412 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.636 ' HG3' ' H ' ' A' ' 2' ' ' CYS . 3.5 tpt . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.877 0.37 . . . . 0.0 111.244 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.636 ' H ' ' HG3' ' A' ' 1' ' ' MET . 0.7 OUTLIER 32.5 -147.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.04 179.926 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.482 ' O ' ' N ' ' A' ' 5' ' ' LYS . 2.3 p30 -163.33 -156.75 0.39 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.81 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.754 ' HB3' ' NE2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -54.33 84.59 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.991 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.517 ' HE3' ' HA ' ' A' ' 5' ' ' LYS . 0.0 OUTLIER -115.72 50.96 0.97 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.838 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.13 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.5 173.9 9.83 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.369 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.921 HG12 ' HE3' ' A' ' 9' ' ' LYS . 47.9 t -123.92 71.49 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.726 179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.992 HD11 HD11 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -41.37 162.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.077 -179.745 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.921 ' HE3' HG12 ' A' ' 7' ' ' VAL . 2.5 mmtt -155.12 -11.3 0.12 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.446 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.508 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -176.22 94.95 0.05 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.616 -179.859 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.903 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.32 84.95 2.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.637 -179.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.746 ' H ' ' HD1' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -73.79 34.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.01 0.433 . . . . 0.0 110.407 179.4 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.886 ' H ' HE22 ' A' ' 18' ' ' GLN . 12.1 ttp -127.69 170.4 12.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.948 -179.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.768 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.3 OUTLIER -61.91 128.8 37.92 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.837 179.682 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.741 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -34.07 -78.69 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.15 -179.861 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.439 ' OE1' ' HG2' ' A' ' 17' ' ' MET . 0.0 OUTLIER -37.21 -35.34 0.11 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.993 -179.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.659 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -70.87 -41.6 71.18 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.166 -179.85 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.886 HE22 ' H ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -66.91 -35.33 79.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.028 -179.766 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.754 ' NE2' ' HB3' ' A' ' 4' ' ' ARG . 4.1 mm100 -73.99 -37.92 64.28 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.139 0.495 . . . . 0.0 109.812 179.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.25 -31.02 62.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.022 179.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.777 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.7 OUTLIER -67.8 -40.77 83.85 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.242 179.308 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.8 HG22 ' CE2' ' A' ' 76' ' ' PHE . 64.0 t -65.52 -50.8 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.425 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.604 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 13.3 mt-10 -53.61 -38.79 64.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.03 179.296 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -69.66 -37.13 76.59 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.898 -0.592 . . . . 0.0 109.791 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.743 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -68.09 -25.12 65.16 Favored 'General case' 0 CA--C 1.514 -0.422 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.114 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.592 ' HA ' HD12 ' A' ' 29' ' ' LEU . 4.2 m -74.93 -45.31 43.29 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.043 -1.435 . . . . 0.0 109.784 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.752 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 53.8 mt-30 -51.82 -47.37 64.35 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.822 -0.626 . . . . 0.0 109.85 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.782 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -74.42 -26.36 60.02 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.199 179.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.937 HD21 HG11 ' A' ' 81' ' ' VAL . 6.6 mt -67.15 -43.58 81.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.14 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.416 ' OE1' ' HG2' ' A' ' 1' ' ' MET . 16.3 mt-10 -94.13 -10.84 31.96 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.12 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.755 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 3.7 mttp -85.01 -21.75 29.33 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 110.588 179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.755 ' CE1' ' HB3' ' A' ' 31' ' ' LYS . 0.1 OUTLIER -148.57 -54.61 0.19 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.452 179.374 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.717 ' C ' HD12 ' A' ' 34' ' ' ILE . 1.8 t30 80.38 26.78 0.29 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.385 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.79 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 0.8 OUTLIER -111.69 91.03 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.604 -0.725 . . . . 0.0 110.851 -179.826 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.711 ' HG2' ' HA2' ' A' ' 59' ' ' GLY . 3.1 mp0 -14.05 -85.86 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 O-C-N 123.603 0.564 . . . . 0.0 111.685 -179.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -40.49 -49.97 2.9 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.816 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.79 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -57.6 -60.1 4.18 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.641 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.866 HG22 HD11 ' A' ' 42' ' ' ILE . 51.7 mt -44.43 -51.86 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.91 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -55.9 -38.9 70.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.005 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.774 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -60.41 -66.36 0.54 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.868 179.872 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.641 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -50.86 -49.68 58.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.733 179.737 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.866 HD11 HG22 ' A' ' 38' ' ' ILE . 94.2 mt -50.24 -52.83 13.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.032 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.913 ' HE3' ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -61.75 -70.2 0.2 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.937 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.774 ' HE2' ' HA ' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -30.99 -50.31 0.14 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 -179.895 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' A' ' 49' ' ' LYS . 3.6 mt-10 -63.84 -67.1 0.46 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.795 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.777 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.6 OUTLIER -40.16 -39.67 0.96 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.783 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.751 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 9.8 t70 -68.29 -42.57 79.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.027 -179.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.404 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -99.0 9.54 43.34 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.166 -179.789 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.56 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -117.32 -23.58 7.76 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.124 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.766 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 84.4 m-85 -120.79 -63.27 1.36 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.272 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.766 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 13.7 t30 162.68 111.81 0.01 OUTLIER Pre-proline 0 N--CA 1.454 -0.245 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.094 -179.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.751 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 81.8 Cg_exo -44.92 156.39 0.25 Allowed 'Trans proline' 0 CA--C 1.533 0.436 0 C-N-CA 122.372 2.048 . . . . 0.0 112.378 -179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.685 ' HA ' ' OD1' ' A' ' 47' ' ' ASP . 6.8 m -112.46 138.64 48.92 Favored 'General case' 0 C--N 1.345 0.41 0 C-N-CA 123.037 0.535 . . . . 0.0 110.511 -0.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.805 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 70.8 m95 -108.43 140.87 41.12 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.446 0.641 . . . . 0.0 112.488 -178.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.885 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.1 OUTLIER -135.13 104.41 5.91 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.836 178.631 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.913 ' HB3' ' HE3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -120.91 165.64 14.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.557 0.694 . . . . 0.0 112.79 -177.676 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.055 HG13 HD23 ' A' ' 84' ' ' LEU . 17.4 mm -132.51 165.21 32.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 114.712 -1.131 . . . . 0.0 109.601 178.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.6 p -162.47 108.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.918 0.39 . . . . 0.0 111.541 -179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.779 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -141.83 -114.62 1.08 Allowed Glycine 0 N--CA 1.446 -0.645 0 N-CA-C 111.511 -0.636 . . . . 0.0 111.511 179.647 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.728 ' HB3' ' O ' ' A' ' 59' ' ' GLY . 0.7 OUTLIER 166.68 -12.88 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 120.636 0.255 . . . . 0.0 111.657 179.789 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -157.78 40.27 0.28 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.672 0.272 . . . . 0.0 111.128 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 1.022 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -106.69 -169.5 1.57 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.951 0.405 . . . . 0.0 111.021 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.892 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.59 86.4 0.24 Allowed Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.974 ' HB2' HD22 ' A' ' 84' ' ' LEU . 70.6 p -81.19 129.23 34.49 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.209 0.528 . . . . 0.0 111.779 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.782 ' H ' HD13 ' B' ' 57' ' ' ILE . 15.7 t80 -137.65 70.65 1.39 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.067 179.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.001 HG13 HD11 ' B' ' 57' ' ' ILE . 3.4 m -100.56 166.62 2.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.709 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.714 HG21 ' OG1' ' B' ' 53' ' ' THR . 1.4 m -114.32 68.53 0.7 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.57 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.5 ' NE2' ' CB ' ' A' ' 12' ' ' ASP . 37.0 p-80 -62.85 -167.27 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.571 -179.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.511 ' HB2' ' H ' ' A' ' 70' ' ' THR . 0.7 OUTLIER -176.15 -140.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.786 -179.891 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.515 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.3 OUTLIER 36.76 -99.36 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.265 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.748 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 175.1 27.04 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.893 -179.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.717 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 98.4 m-70 -119.4 49.14 1.39 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.435 179.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.746 ' HD1' ' H ' ' A' ' 12' ' ' ASP . 0.3 OUTLIER -128.15 126.44 41.08 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.541 -179.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.992 HD11 HD11 ' A' ' 8' ' ' ILE . 1.4 tt -134.72 137.48 50.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.997 0.427 . . . . 0.0 111.342 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.508 ' N ' ' O ' ' A' ' 10' ' ' ASN . 16.8 t80 -124.06 129.67 51.27 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.036 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.971 ' HE1' HG23 ' A' ' 74' ' ' ILE . 0.5 OUTLIER -159.1 167.7 28.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.01 0.433 . . . . 0.0 111.358 -179.525 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.661 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 28.2 t80 -131.21 93.29 3.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.546 179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.13 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -48.87 175.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.957 -179.692 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -29.66 -54.27 0.19 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.665 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -141.41 32.65 1.68 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.865 0.364 . . . . 0.0 110.961 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.937 HG11 HD21 ' A' ' 29' ' ' LEU . 60.1 t -146.49 170.85 4.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.056 179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.924 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -131.48 153.43 49.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.713 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.924 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -144.27 121.57 5.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.925 0.393 . . . . 0.0 111.42 -179.786 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.055 HD23 HG13 ' A' ' 57' ' ' ILE . 3.2 tp -112.41 90.74 3.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.317 179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.774 ' HG ' ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -94.76 146.21 24.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.87 -179.32 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.728 ' HB3' ' HD2' ' A' ' 73' ' ' PHE . 7.8 p90 177.21 140.56 0.08 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.936 179.185 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.851 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 6.4 mtpm? -99.18 -179.03 4.11 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.987 -179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.885 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -124.59 19.81 8.69 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.265 0.555 . . . . 0.0 110.723 179.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.472 ' O ' ' NZ ' ' A' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.379 -1.234 . . . . 0.0 112.538 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.438 ' O ' ' C ' ' B' ' 2' ' ' CYS . 2.5 ttp . . . . . 0 N--CA 1.487 1.418 0 CA-C-O 120.842 0.353 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.438 ' C ' ' O ' ' B' ' 1' ' ' MET . 0.2 OUTLIER -34.27 -72.82 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.955 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.513 ' HB2' ' H ' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -129.47 -97.96 0.36 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.962 -179.916 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.724 HH22 HD13 ' B' ' 8' ' ' ILE . 0.2 OUTLIER 67.27 -71.33 0.1 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.009 -179.988 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.482 ' HD2' ' HA ' ' B' ' 5' ' ' LYS . 11.1 mmmt 39.45 28.73 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.531 -179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.006 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.44 -167.47 1.77 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.067 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.694 ' O ' ' HE2' ' B' ' 9' ' ' LYS . 75.7 t -152.88 74.33 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.972 -179.988 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.815 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.8 OUTLIER -42.84 159.78 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.236 0.541 . . . . 0.0 110.861 -179.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.694 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 5.7 mmtt -152.15 -14.73 0.18 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.896 179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.579 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.9 OUTLIER -171.4 108.69 0.27 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.778 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.784 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -141.61 102.77 4.25 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.876 0.37 . . . . 0.0 111.653 -179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.792 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 1.7 t70 -85.77 26.28 0.99 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.439 179.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.884 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 11.0 ttp -114.89 157.53 23.2 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.743 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.745 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.7 OUTLIER -46.24 152.6 0.4 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.619 179.697 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.68 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 2.5 mt-10 -56.48 -70.27 0.12 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.127 -179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.463 ' HA ' ' HG2' ' B' ' 19' ' ' GLN . 0.8 OUTLIER -49.58 -25.67 2.95 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.989 0.423 . . . . 0.0 110.533 179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.797 ' HE2' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -74.3 -41.9 60.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.828 179.796 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.832 ' O ' HG23 ' B' ' 22' ' ' VAL . 0.0 OUTLIER -68.47 -25.37 64.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.68 179.82 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.702 ' HG3' ' N ' ' B' ' 20' ' ' ASP . 0.0 OUTLIER -78.46 -39.98 36.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.016 179.498 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.702 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 0.3 OUTLIER -72.96 -24.4 60.78 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.053 179.213 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.793 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -74.4 -48.04 30.27 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.27 179.387 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.848 HG13 ' CE2' ' B' ' 76' ' ' PHE . 37.4 t -61.91 -39.76 84.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.463 179.462 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.527 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 68.7 mt-10 -66.12 -38.81 89.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.067 179.4 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' B' ' 20' ' ' ASP . 99.2 m -67.62 -35.25 78.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.712 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.76 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -69.49 -35.8 75.9 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 178.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.819 ' HA ' HD12 ' B' ' 29' ' ' LEU . 88.2 m -65.05 -42.12 94.55 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 114.135 -1.393 . . . . 0.0 109.522 178.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 32.5 mt-30 -54.35 -46.81 73.05 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.585 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.78 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -74.01 -16.89 61.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.186 179.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.819 HD12 ' HA ' ' B' ' 26' ' ' THR . 3.3 mt -80.66 -41.33 23.96 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.107 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -78.75 -30.22 45.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.799 -179.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.681 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 7.8 mmtp -84.4 -19.46 33.49 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.623 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.681 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -158.34 149.89 21.21 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.813 179.679 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -117.31 27.45 9.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.7 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 1.017 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.3 mm -108.43 106.42 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.928 179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.892 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 35.7 mp0 -30.24 -70.71 0.05 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.527 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.33 -60.31 2.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.691 179.785 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 1.017 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.1 OUTLIER -44.48 -65.41 0.52 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.55 179.707 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.78 HG23 ' CB ' ' B' ' 28' ' ' ALA . 10.9 mt -46.64 -45.12 7.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.325 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -61.99 -43.77 98.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.394 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.531 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -60.82 -64.86 0.81 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.028 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.689 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -42.37 -56.14 3.1 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.646 179.882 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.76 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 55.7 mt -46.82 -68.23 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.109 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.637 ' HD3' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -36.45 -57.15 0.77 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.265 -179.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 54.7 mttt -52.61 -39.74 61.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.462 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.593 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -73.53 -41.88 62.44 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.196 -179.612 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.793 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -64.9 -37.39 87.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.74 179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.858 ' HB3' ' HG3' ' B' ' 52' ' ' PRO . 8.0 m-20 -68.32 -46.24 70.77 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.892 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.412 ' HE3' ' HB3' ' B' ' 48' ' ' LYS . 22.0 mmmt -79.19 -25.11 42.8 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.037 -179.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.593 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 4.6 tttm -90.16 -12.44 38.17 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.155 -179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.55 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 86.0 m-85 -133.39 -71.43 0.51 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.344 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 1.9 m-20 157.85 107.46 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.14 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.069 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.858 ' HG3' ' HB3' ' B' ' 47' ' ' ASP . 72.0 Cg_exo -35.58 156.84 0.02 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 122.52 2.147 . . . . 0.0 112.691 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.735 HG23 ' CE1' ' B' ' 55' ' ' HIS . 4.7 t -120.94 123.26 42.04 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 123.016 0.527 . . . . 0.0 111.006 -0.02 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.962 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 37.6 m95 -92.79 118.99 31.69 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.915 -179.503 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.812 ' HE2' ' HB2' ' B' ' 88' ' ' SER . 1.9 m-70 -99.54 99.39 10.26 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.764 ' CB ' HD12 ' B' ' 85' ' ' LEU . 24.4 p -114.96 146.39 41.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.264 0.554 . . . . 0.0 112.471 -178.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 1.001 HD11 HG13 ' A' ' 66' ' ' VAL . 22.7 mm -128.19 111.51 24.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.248 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.184 178.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -111.11 135.24 50.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 120.877 0.37 . . . . 0.0 111.634 -179.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.594 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -165.22 -137.52 2.22 Favored Glycine 0 N--CA 1.45 -0.372 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.967 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.449 ' O ' ' CB ' ' B' ' 61' ' ' ASN . 0.1 OUTLIER -172.33 34.07 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 120.775 0.321 . . . . 0.0 111.269 -179.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.449 ' CB ' ' O ' ' B' ' 60' ' ' ARG . 0.9 OUTLIER 163.81 27.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.776 179.815 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 1.022 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 2.7 p90 -100.67 165.81 11.2 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.866 179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.661 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -121.12 84.29 0.37 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.976 179.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.905 ' CB ' HD22 ' B' ' 84' ' ' LEU . 3.0 p -79.76 139.27 37.34 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.006 0.432 . . . . 0.0 111.444 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.82 ' H ' HD13 ' A' ' 57' ' ' ILE . 4.1 t80 -149.17 64.18 1.03 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.446 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.703 ' HA ' ' HB3' ' A' ' 55' ' ' HIS . 24.3 m -101.78 140.79 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.22 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.532 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 17.4 m -85.33 95.43 9.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.909 -179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.612 ' HB3' ' CG ' ' B' ' 73' ' ' PHE . 14.8 p-80 -57.52 -150.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.809 179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.727 ' O ' HG22 ' B' ' 70' ' ' THR . 0.0 OUTLIER 168.73 116.11 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.148 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 1.092 HG23 ' HG2' ' B' ' 71' ' ' LYS . 0.5 OUTLIER 81.01 -59.4 0.26 Allowed 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.912 -0.586 . . . . 0.0 111.476 179.625 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 1.092 ' HG2' HG23 ' B' ' 70' ' ' THR . 0.0 OUTLIER 174.53 -158.44 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.88 0.371 . . . . 0.0 110.874 -179.756 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.884 ' HA ' ' SD ' ' B' ' 13' ' ' MET . 29.7 m170 64.1 17.77 10.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.015 179.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.855 ' HA ' ' HA ' ' B' ' 86' ' ' PHE . 4.0 t80 -114.26 77.36 1.05 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.478 179.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.789 HD13 ' CE1' ' B' ' 76' ' ' PHE . 1.6 tt -96.0 149.05 4.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.126 0.489 . . . . 0.0 111.469 -179.666 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.579 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.3 OUTLIER -140.79 125.5 18.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.619 179.145 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.848 ' CE2' HG13 ' B' ' 22' ' ' VAL . 4.5 p90 -155.3 167.38 30.56 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 120.975 0.417 . . . . 0.0 111.24 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.549 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 10.9 t80 -124.06 111.02 15.47 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.976 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.006 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -72.65 170.48 14.41 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.678 179.711 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.498 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.23 -50.0 0.05 OUTLIER Glycine 0 C--N 1.331 0.286 0 C-N-CA 121.057 -0.592 . . . . 0.0 112.695 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -146.05 37.59 1.05 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.958 0.409 . . . . 0.0 110.692 179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.817 HG11 HD21 ' B' ' 29' ' ' LEU . 93.3 t -152.08 170.4 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.863 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.709 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -142.66 115.01 8.44 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.842 0.353 . . . . 0.0 110.919 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.71 HD13 HG23 ' B' ' 58' ' ' VAL . 0.4 OUTLIER -101.75 129.77 52.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.253 -179.851 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.905 HD22 ' CB ' ' B' ' 64' ' ' SER . 0.3 OUTLIER -118.2 87.14 2.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.532 179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.764 HD12 ' CB ' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -89.46 134.62 34.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.73 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.855 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.0 OUTLIER -160.27 126.86 4.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.62 179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.962 ' HG3' ' HA ' ' B' ' 54' ' ' TRP . 0.0 OUTLIER -110.32 142.95 41.25 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.024 -179.736 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.812 ' HB2' ' HE2' ' B' ' 55' ' ' HIS . 0.2 OUTLIER -86.21 19.35 2.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.211 0.529 . . . . 0.0 110.729 -179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.421 -1.21 . . . . 0.0 112.506 179.901 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.776 0.322 . . . . 0.0 111.132 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 8.3 m -93.07 -61.84 1.5 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.816 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 5' ' ' LYS . 40.8 t0 70.1 71.33 0.22 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.866 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.717 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER 53.27 -87.21 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.974 -179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.672 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.0 OUTLIER 56.82 97.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.807 -179.954 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.998 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 160.59 168.3 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.915 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.672 HG12 ' O ' ' A' ' 7' ' ' VAL . 98.8 t -131.13 60.75 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.929 179.79 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.859 HD11 HD11 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -36.04 132.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.694 -179.897 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -114.33 -16.29 12.01 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.984 179.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.595 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 1.7 m-20 -173.99 160.06 3.44 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.665 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.595 ' HB2' ' O ' ' A' ' 10' ' ' ASN . . . 171.07 113.86 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.756 -0.378 . . . . 0.0 111.778 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.732 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 41.6 m-20 -98.52 27.62 4.68 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.024 179.179 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.896 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -107.59 168.02 9.54 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.562 -179.831 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.896 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -53.69 146.83 12.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.882 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.721 ' HA ' ' OE1' ' A' ' 18' ' ' GLN . 0.8 OUTLIER -56.53 -62.01 2.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.764 179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.503 ' H ' ' CD ' ' A' ' 16' ' ' GLU . 2.6 mp0 -53.96 -24.99 18.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.857 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.586 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 60.2 mmm -77.67 -45.86 23.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.99 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.854 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -61.77 -33.16 73.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.72 179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.717 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 4.7 mt-30 -75.53 -40.37 57.03 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.149 0.499 . . . . 0.0 109.7 179.292 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.766 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 1.4 m-20 -69.73 -30.81 68.5 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.548 178.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.3 OUTLIER -64.45 -50.31 68.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.824 179.198 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.775 HG22 ' CD2' ' A' ' 76' ' ' PHE . 70.3 t -55.43 -47.4 78.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.009 179.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -53.73 -39.3 65.14 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.161 179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.53 ' HG ' ' HD1' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -65.43 -41.32 93.64 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.045 179.24 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.668 ' HB2' HG21 ' A' ' 83' ' ' ILE . . . -66.69 -28.94 68.85 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 178.417 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.685 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.6 OUTLIER -72.73 -42.25 64.3 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 114.287 -1.324 . . . . 0.0 109.641 178.655 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.497 HE21 ' HB3' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -51.62 -46.06 63.49 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.528 179.365 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.926 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -81.07 -20.55 41.31 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.683 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.739 HD11 ' HG ' ' A' ' 78' ' ' LEU . 6.7 mt -77.46 -29.93 52.99 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.249 179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -92.13 -34.77 14.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.204 -179.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.563 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -82.9 -14.14 54.76 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.913 0.387 . . . . 0.0 110.449 179.725 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.633 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.35 169.7 22.45 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.761 179.535 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.725 ' C ' HD13 ' A' ' 34' ' ' ILE . 1.3 t30 -137.93 29.18 2.57 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.913 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 1.2 mm -116.63 108.22 24.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.065 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.682 ' HA ' HD12 ' A' ' 38' ' ' ILE . 23.6 mp0 -29.1 -74.34 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.942 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.503 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.4 OUTLIER -42.61 -61.08 1.32 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.753 179.634 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.913 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.3 OUTLIER -44.43 -62.85 1.03 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.989 0.423 . . . . 0.0 110.401 179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.926 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 3.3 mt -45.18 -48.46 3.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.878 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.868 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -57.94 -43.85 86.57 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.071 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.799 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -55.94 -64.77 0.75 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.147 -0.478 . . . . 0.0 111.067 179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.692 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -49.15 -56.8 8.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.931 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.815 HD11 HG22 ' A' ' 38' ' ' ILE . 47.3 mt -42.52 -62.52 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.952 ' HE2' ' H ' ' A' ' 54' ' ' TRP . 13.0 tptp -51.49 -60.44 3.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.01 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 tttp -36.93 -56.02 0.89 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.069 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.478 ' O ' ' N ' ' A' ' 48' ' ' LYS . 18.3 tt0 -60.97 -69.06 0.25 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.912 -179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.3 OUTLIER -37.35 -38.16 0.22 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.315 -179.84 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.708 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.1 OUTLIER -71.58 -38.52 70.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.471 -179.467 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.478 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -101.64 9.96 40.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.723 0.297 . . . . 0.0 111.373 -179.643 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.42 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -125.54 -7.48 6.88 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.323 -179.899 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.766 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 39.8 m-85 -133.04 -63.3 0.77 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.994 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.1 OUTLIER 161.79 108.86 0.01 OUTLIER Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.313 -179.979 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.708 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 73.0 Cg_exo -49.53 153.56 5.11 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 122.446 2.097 . . . . 0.0 112.434 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 1.027 HG21 HG21 ' B' ' 67' ' ' THR . 44.5 m -117.06 137.11 52.48 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 122.998 0.519 . . . . 0.0 110.699 0.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.952 ' H ' ' HE2' ' A' ' 43' ' ' LYS . 64.8 m95 -98.76 160.81 14.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.39 0.614 . . . . 0.0 111.748 -179.418 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.864 ' HD2' ' HA ' ' A' ' 87' ' ' LYS . 2.4 m-70 -141.26 100.42 3.79 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.016 179.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.943 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.8 OUTLIER -113.27 144.35 42.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.355 0.597 . . . . 0.0 112.573 -178.051 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.976 HG12 HD23 ' A' ' 84' ' ' LEU . 18.0 mm -132.87 111.82 17.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.121 -0.945 . . . . 0.0 110.334 179.039 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.868 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.8 p -111.01 126.83 68.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.933 0.397 . . . . 0.0 111.58 -179.397 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.609 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -147.48 -151.34 5.4 Favored Glycine 0 N--CA 1.449 -0.473 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.821 179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.677 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -155.5 26.02 0.4 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.773 0.287 . . . . 0.0 111.586 -179.75 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.677 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.1 OUTLIER 164.5 26.95 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.847 0.356 . . . . 0.0 111.143 179.637 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.861 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 14.8 p90 -102.67 -179.54 4.0 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.842 179.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.786 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -132.6 108.57 0.78 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.785 179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.861 ' HB3' ' HE1' ' A' ' 62' ' ' PHE . 7.2 p -93.94 124.75 38.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.982 0.42 . . . . 0.0 111.53 -179.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.814 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 33.1 t80 -135.8 82.14 1.93 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.376 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.851 HG13 HD11 ' B' ' 57' ' ' ILE . 14.6 m -125.89 152.27 32.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.4 -179.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 1.032 HG21 HG21 ' B' ' 53' ' ' THR . 0.6 OUTLIER -79.49 115.71 19.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.561 179.617 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.821 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.7 OUTLIER -74.87 148.41 40.2 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.96 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.752 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 3.5 mm-40 -113.94 -131.52 0.32 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.481 -179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.583 ' OG1' ' N ' ' A' ' 71' ' ' LYS . 0.1 OUTLIER -27.57 -99.32 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.679 -179.56 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.751 ' O ' ' HB2' ' A' ' 13' ' ' MET . 0.1 OUTLIER -70.29 22.49 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.962 0.41 . . . . 0.0 110.697 -179.602 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.821 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 24.6 m-70 56.97 -85.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.874 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.744 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 164.61 -170.3 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.895 179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.859 HD11 HD11 ' A' ' 8' ' ' ILE . 0.0 OUTLIER -160.34 110.39 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.597 179.771 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.597 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 34.6 t80 -103.71 137.26 42.0 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.605 179.597 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.84 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.5 OUTLIER -151.17 169.73 21.17 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.81 -179.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.777 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 10.2 t80 -126.59 98.11 5.27 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.002 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.998 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.3 OUTLIER -59.46 177.71 0.18 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.73 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.546 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -56.63 81.4 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.397 -0.906 . . . . 0.0 111.464 179.334 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.777 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.0 OUTLIER 84.1 22.87 0.12 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.177 0.513 . . . . 0.0 110.016 -178.9 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.907 ' HB ' ' HB2' ' A' ' 78' ' ' LEU . 72.5 t -142.63 173.02 7.36 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.75 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.756 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -146.25 146.26 30.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.695 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.817 HD13 HG23 ' A' ' 58' ' ' VAL . 0.7 OUTLIER -135.79 133.1 51.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 121.008 0.432 . . . . 0.0 111.531 -179.517 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.976 HD23 HG12 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -118.34 93.96 4.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.045 179.595 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.766 HD11 HG21 ' A' ' 42' ' ' ILE . 0.7 OUTLIER -98.81 124.67 43.85 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.636 -179.155 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.782 ' CE1' HG21 ' A' ' 66' ' ' VAL . 18.7 p90 -162.72 129.95 3.66 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.049 179.43 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.864 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 1.0 OUTLIER -104.87 151.17 24.16 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.926 0.393 . . . . 0.0 111.159 -179.785 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.752 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -109.87 19.02 19.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.329 0.585 . . . . 0.0 110.741 179.846 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.415 -1.214 . . . . 0.0 112.593 -179.888 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.482 ' O ' ' C ' ' B' ' 2' ' ' CYS . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.861 0.363 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.482 ' C ' ' O ' ' B' ' 1' ' ' MET . 63.0 m 32.14 91.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.565 ' O ' ' HD3' ' B' ' 4' ' ' ARG . 10.9 m-20 -118.64 61.89 0.78 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.935 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.565 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 27.0 mmt-85 -129.43 -66.01 0.83 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.965 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.505 ' O ' HG11 ' B' ' 22' ' ' VAL . 0.0 OUTLIER 72.51 174.36 0.29 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.828 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.03 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 66.06 164.64 0.18 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.422 179.794 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.601 ' O ' ' HG2' ' B' ' 9' ' ' LYS . 24.3 t -130.43 71.9 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.739 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.814 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -32.08 152.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.77 -179.845 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.824 ' HB2' ' HD2' ' B' ' 75' ' ' TYR . 1.8 mmpt? -147.16 -6.77 0.48 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.511 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.602 ' HB3' ' HZ ' ' B' ' 73' ' ' PHE . 0.3 OUTLIER -176.65 90.67 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.516 179.905 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.878 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -127.98 97.74 4.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.423 -179.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.83 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 1.4 m-20 -95.07 25.96 3.93 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.067 0.46 . . . . 0.0 110.393 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.726 ' HG3' ' H ' ' B' ' 14' ' ' SER . 12.8 ttp -110.4 168.78 9.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.544 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.726 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.6 OUTLIER -49.24 125.83 11.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.766 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.488 ' HA ' ' CG ' ' B' ' 18' ' ' GLN . 45.9 mt-10 -39.29 -56.37 1.55 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.785 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -56.41 -30.6 62.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.968 -179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.532 ' CB ' ' HG2' ' B' ' 13' ' ' MET . 30.8 mmm -72.82 -44.09 61.89 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.071 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 1.032 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -62.94 -32.39 73.69 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.073 -179.769 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 6.2 mt-30 -75.03 -42.77 56.56 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-O 121.196 0.522 . . . . 0.0 109.682 179.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.55 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 25.1 m-20 -68.1 -28.87 67.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.511 179.134 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.786 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -66.67 -48.62 68.78 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.956 179.094 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.825 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 90.9 t -55.27 -50.15 66.97 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.136 179.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -56.83 -34.99 68.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.141 -0.481 . . . . 0.0 109.948 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.473 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 3.2 m -69.55 -36.12 76.05 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.984 -0.553 . . . . 0.0 109.754 178.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.77 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.36 -28.81 64.32 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 178.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 3.7 m -74.31 -40.39 62.27 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.75 178.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.769 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 1.8 mm-40 -56.6 -44.43 81.12 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.681 179.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.978 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -68.21 -36.7 79.95 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.067 178.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.77 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.8 mt -65.46 -41.08 93.79 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.942 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.59 -25.88 54.43 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.736 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.769 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 23.6 mmtm -88.12 -22.65 23.99 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.687 179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.53 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -159.66 163.71 34.66 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.699 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.469 ' OD1' ' N ' ' B' ' 33' ' ' ASN . 0.0 OUTLIER -123.28 29.75 6.57 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.935 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.746 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.7 mm -113.67 106.41 20.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.892 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.786 ' HB3' ' HA3' ' A' ' 63' ' ' GLY . 1.2 mp0 -29.89 -70.34 0.06 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.898 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.438 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -43.33 -52.33 5.88 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.633 179.559 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.746 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 7.0 t0 -55.49 -60.49 3.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.369 179.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.978 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 3.8 mt -42.74 -55.1 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.713 179.528 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.98 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.46 -53.73 21.5 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.518 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.814 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -51.37 -69.29 0.12 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.263 179.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.755 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.4 OUTLIER -33.78 -42.13 0.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.359 179.134 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.747 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 53.6 mt -69.04 -66.35 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.324 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.596 ' HD3' ' CD1' ' A' ' 65' ' ' TYR . 7.3 tttp -40.49 -43.55 1.86 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.075 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 1.4 mmtp -69.02 -49.4 58.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.277 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.561 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 41.6 tt0 -63.22 -25.95 68.57 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.786 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -79.33 -37.81 36.67 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.874 0.369 . . . . 0.0 110.771 179.911 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.933 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.62 -32.82 73.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.609 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 1.4 mmmt -90.56 -33.78 15.76 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.221 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.561 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 7.7 tttp -81.03 -12.66 59.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.387 -179.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.751 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 17.4 m-85 -142.75 -66.59 0.38 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.658 0.266 . . . . 0.0 111.596 -179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.751 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.2 t30 160.74 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.398 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.933 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 21.0 Cg_endo -60.43 169.42 5.29 Favored 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.472 2.115 . . . . 0.0 112.377 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 1.032 HG21 HG21 ' A' ' 67' ' ' THR . 1.8 t -110.89 120.73 43.37 Favored 'General case' 0 C--N 1.344 0.333 0 C-N-CA 122.926 0.49 . . . . 0.0 110.733 0.077 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.856 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 31.2 m95 -90.55 141.23 28.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.46 -179.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.815 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 4.1 m170 -107.1 105.39 15.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.338 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.69 ' O ' HD13 ' B' ' 57' ' ' ILE . 9.8 t -111.74 133.08 54.21 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -178.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.997 ' CG1' HD23 ' B' ' 84' ' ' LEU . 23.8 mm -127.08 99.78 5.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.56 178.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 0.98 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.6 p -104.98 118.78 52.97 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.048 0.451 . . . . 0.0 111.847 -178.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.905 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -134.87 -116.03 1.59 Allowed Glycine 0 N--CA 1.448 -0.507 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.198 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -174.15 -31.86 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.786 0.327 . . . . 0.0 111.022 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.432 ' HA ' HD22 ' B' ' 61' ' ' ASN . 0.0 OUTLIER -154.67 43.11 0.49 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.925 -179.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.913 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 27.9 p90 -99.68 -167.15 1.42 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.923 0.392 . . . . 0.0 111.07 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.681 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -140.5 98.11 0.23 Allowed Glycine 0 N--CA 1.449 -0.495 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.709 179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.941 ' CB ' HD22 ' B' ' 84' ' ' LEU . 3.8 p -89.22 128.42 35.82 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.996 0.427 . . . . 0.0 111.668 -179.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.799 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 52.5 t80 -139.48 86.54 2.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.343 179.341 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.922 HG13 HD11 ' A' ' 57' ' ' ILE . 12.2 m -136.92 141.42 40.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.179 -179.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 1.027 HG21 HG21 ' A' ' 53' ' ' THR . 1.3 t -70.37 139.54 51.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.043 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.783 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -98.76 162.15 13.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.524 179.62 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.532 ' HB2' ' H ' ' B' ' 70' ' ' THR . 0.1 OUTLIER -131.75 -101.26 0.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.33 -179.758 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.557 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -46.04 -108.08 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.389 -179.525 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.687 ' O ' ' HB2' ' B' ' 13' ' ' MET . 2.1 mmtp -70.5 29.3 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.88 -179.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.83 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 37.9 m-70 57.22 -83.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.778 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 163.05 -153.62 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.73 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 1.032 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.6 OUTLIER -172.54 135.6 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.549 179.686 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.824 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 5.2 t80 -124.05 139.62 53.76 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.999 179.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.825 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 0.8 OUTLIER -165.73 147.11 7.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.977 -179.879 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.723 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 64.5 t80 -112.7 109.5 19.05 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.876 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.03 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.4 mm? -69.1 169.55 11.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.061 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.543 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -19.75 -67.86 0.01 OUTLIER Glycine 0 C--N 1.335 0.479 0 C-N-CA 121.207 -0.521 . . . . 0.0 112.86 -179.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.422 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 0.0 OUTLIER -130.86 39.0 3.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.049 0.452 . . . . 0.0 110.064 179.223 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.905 HG13 ' O ' ' B' ' 59' ' ' GLY . 93.0 t -152.69 170.18 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.114 -179.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.99 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -131.51 162.15 30.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.367 179.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.99 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -145.61 133.98 16.6 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 120.977 0.417 . . . . 0.0 111.489 -179.615 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.997 HD23 ' CG1' ' B' ' 57' ' ' ILE . 4.9 tp -124.15 88.19 2.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.444 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.757 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -95.02 122.33 37.57 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.246 -179.44 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.838 ' CE2' HG21 ' B' ' 66' ' ' VAL . 0.5 OUTLIER -153.52 120.1 5.58 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.022 179.878 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.856 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -86.22 132.06 34.09 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.893 179.83 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.815 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 2.4 m -94.73 19.53 9.9 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.228 0.537 . . . . 0.0 110.956 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . 0.471 ' OXT' ' NZ ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.368 -1.24 . . . . 0.0 112.525 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mtt . . . . . 0 N--CA 1.487 1.4 0 CA-C-O 120.759 0.314 . . . . 0.0 111.262 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.613 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -82.5 -134.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.724 179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.613 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 1.9 t70 168.85 88.45 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.983 179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 1.031 ' HG3' HG11 ' A' ' 22' ' ' VAL . 0.3 OUTLIER -93.87 -41.14 9.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.654 179.814 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.474 ' C ' ' O ' ' A' ' 4' ' ' ARG . 0.5 OUTLIER 30.67 40.21 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.295 179.788 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.095 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -131.07 -171.05 2.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.128 179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.451 ' N ' ' O ' ' A' ' 77' ' ' TYR . 25.9 t -145.79 78.69 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.262 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.802 ' HA ' ' HB3' ' A' ' 76' ' ' PHE . 1.4 mp -40.03 142.41 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 179.533 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.479 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 3.7 mmpt? -129.83 -12.78 4.22 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.03 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.57 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 14.4 t30 -154.89 -90.33 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.491 179.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 1.086 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 76.68 -176.59 0.12 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.619 179.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.777 ' O ' ' HA ' ' A' ' 71' ' ' LYS . 1.0 OUTLIER 162.23 22.29 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.343 -0.844 . . . . 0.0 109.807 -179.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.923 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 11.0 ttp -114.58 164.59 13.8 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.687 -179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 1.044 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 68.5 m -45.3 135.27 6.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.522 179.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.473 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.2 mm-40 -41.67 -75.89 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.071 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -44.68 -22.15 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.849 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 1.044 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -79.54 -39.73 31.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.952 -179.94 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.816 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -67.73 -30.1 69.5 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.589 179.811 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.26 -45.77 19.11 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 179.25 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -68.18 -29.49 68.36 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.484 178.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.816 ' OG ' HG21 ' A' ' 74' ' ' ILE . 0.2 OUTLIER -66.66 -50.83 61.64 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.086 179.182 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 1.031 HG11 ' HG3' ' A' ' 4' ' ' ARG . 58.0 t -57.13 -40.36 72.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.343 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.538 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 4.2 mt-10 -63.85 -34.66 78.44 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.203 179.381 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -71.78 -34.06 69.12 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.764 178.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.696 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -73.42 -34.15 65.33 Favored 'General case' 0 CA--C 1.514 -0.423 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.832 ' HA ' HD12 ' A' ' 29' ' ' LEU . 42.0 m -71.71 -40.19 69.64 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.552 -1.204 . . . . 0.0 109.619 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.823 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -56.17 -43.33 78.28 Favored 'General case' 0 CA--C 1.519 -0.248 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.249 178.94 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.943 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -74.93 -22.92 58.32 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.807 178.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.832 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.9 mt -73.46 -38.38 65.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.547 -0.752 . . . . 0.0 110.945 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.01 -25.21 26.09 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.921 -179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.768 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.3 OUTLIER -83.92 -35.27 24.18 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.725 179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.654 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -149.92 150.58 32.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.78 179.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.664 ' HA ' HD11 ' A' ' 38' ' ' ILE . 2.2 t-20 -127.51 48.57 2.22 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.772 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.887 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 40.4 mm -115.45 43.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.081 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.701 ' HG2' ' HA ' ' B' ' 62' ' ' PHE . 3.1 mp0 34.56 -87.56 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.596 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.613 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -43.19 -53.75 4.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.865 0.364 . . . . 0.0 110.456 179.53 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.887 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 3.4 t70 -45.86 -61.94 1.52 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.588 179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.943 HG23 ' HB3' ' A' ' 28' ' ' ALA . 3.7 mt -45.5 -58.06 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.166 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.933 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -49.29 -54.61 16.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.718 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -42.53 -55.24 3.57 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.111 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.539 ' CE1' ' CD1' ' A' ' 32' ' ' TYR . 0.1 OUTLIER -61.13 -50.26 73.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.817 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.703 ' CG2' HD11 ' A' ' 85' ' ' LEU . 64.2 mt -47.68 -69.81 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.218 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.852 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -49.97 -67.08 0.29 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.987 -179.909 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.788 ' HD2' ' N ' ' A' ' 45' ' ' GLU . 0.2 OUTLIER -33.0 -59.69 0.34 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.911 -179.974 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.788 ' N ' ' HD2' ' A' ' 44' ' ' LYS . 5.2 tp10 -54.66 -54.84 36.37 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.717 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.704 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.4 OUTLIER -52.66 -31.65 38.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.942 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.73 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.9 OUTLIER -72.94 -32.15 65.07 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.872 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.3 mmmm -106.27 4.61 28.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.372 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.484 ' O ' ' CG ' ' A' ' 50' ' ' TYR . 6.2 tttp -123.98 13.75 9.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.789 0.328 . . . . 0.0 111.101 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.675 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 57.2 m-85 -159.94 -66.9 0.07 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.12 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.488 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 0.6 OUTLIER 162.09 115.57 0.01 OUTLIER Pre-proline 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.726 -179.773 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.73 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 36.4 Cg_endo -64.98 170.49 10.25 Favored 'Trans proline' 0 CA--C 1.533 0.461 0 C-N-CA 122.433 2.089 . . . . 0.0 112.398 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.68 ' O ' ' HG2' ' A' ' 87' ' ' LYS . 1.5 t -102.65 128.12 49.47 Favored 'General case' 0 C--N 1.345 0.373 0 C-N-CA 122.86 0.464 . . . . 0.0 110.358 -0.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.836 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 63.6 m95 -94.27 151.44 19.44 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.407 0.622 . . . . 0.0 111.929 -179.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.826 ' HB2' ' CE2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -136.67 94.19 2.96 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.947 -1.024 . . . . 0.0 108.954 179.257 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.995 ' HB2' HD12 ' A' ' 85' ' ' LEU . 8.8 p -115.97 154.9 29.0 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.349 0.595 . . . . 0.0 112.422 -178.122 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.994 HD12 ' HA ' ' B' ' 64' ' ' SER . 16.3 mm -126.96 174.71 10.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.05 -0.977 . . . . 0.0 110.001 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.933 HG12 ' HB2' ' A' ' 39' ' ' ALA . 8.1 p -170.88 110.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 120.961 0.41 . . . . 0.0 111.76 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.686 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.39 -135.83 2.15 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.765 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.447 ' H ' ' H ' ' A' ' 61' ' ' ASN . 4.5 ptt180 -173.69 -9.85 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.476 0 CA-C-O 120.686 0.279 . . . . 0.0 111.359 -179.866 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.587 ' H ' HD22 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -148.72 44.83 1.02 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.087 -179.896 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.849 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -120.19 165.73 14.41 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.93 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.854 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -112.77 86.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.989 -0.624 . . . . 0.0 111.792 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.952 ' HA ' HG23 ' B' ' 57' ' ' ILE . 2.9 p -81.91 118.56 23.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.045 0.45 . . . . 0.0 111.58 -179.232 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.984 ' H ' HD13 ' B' ' 57' ' ' ILE . 7.4 t80 -132.37 76.68 1.71 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.56 179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.006 HG13 HD11 ' B' ' 57' ' ' ILE . 5.5 m -127.55 140.44 49.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.327 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.824 HG21 HG21 ' B' ' 53' ' ' THR . 3.3 t -95.69 120.52 36.09 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.905 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.435 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -60.95 -164.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.876 -179.89 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.521 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 1.0 OUTLIER -127.11 -46.84 1.5 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.346 -179.752 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.504 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 28.3 m -157.92 -42.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.481 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.777 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 7.7 mtpt -164.7 -159.54 0.46 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.758 0.313 . . . . 0.0 110.882 -179.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 1.044 ' HB2' ' HB2' ' A' ' 87' ' ' LYS . 0.0 OUTLIER 56.17 18.82 3.45 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.011 0.434 . . . . 0.0 110.436 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.829 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 7.0 t80 -116.15 101.61 8.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.498 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 1.086 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -121.4 118.25 55.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.316 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -115.21 94.6 4.8 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.763 179.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.819 ' CZ ' ' HA ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -114.7 -178.88 3.47 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.164 -179.778 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.688 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 16.1 t80 -140.31 102.69 4.41 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.642 179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.095 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -59.64 173.05 0.6 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.273 -179.707 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.96 -44.86 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.923 -0.581 . . . . 0.0 112.936 -179.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.418 ' N ' ' O ' ' A' ' 78' ' ' LEU . 0.0 OUTLIER -148.21 26.28 0.98 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.22 -179.902 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.754 HG11 HD21 ' A' ' 29' ' ' LEU . 72.2 t -139.65 168.3 18.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.989 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.723 ' O ' ' HA ' ' A' ' 58' ' ' VAL . . . -136.63 125.88 24.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.793 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.594 HG21 ' CB ' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -113.23 119.99 62.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.961 0.41 . . . . 0.0 110.993 -179.797 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.981 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 21.4 tp -100.78 80.45 2.17 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.89 -0.596 . . . . 0.0 111.18 -179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.995 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -86.32 137.78 32.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.072 179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.829 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 0.5 OUTLIER -174.23 127.96 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.563 179.635 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 1.044 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -90.14 -169.75 2.53 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.925 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.521 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -122.78 19.73 10.19 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.308 0.575 . . . . 0.0 110.81 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.086 0 CA-C-O 118.413 -1.215 . . . . 0.0 112.499 -179.99 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.482 ' O ' ' HB3' ' B' ' 2' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.77 0.319 . . . . 0.0 111.129 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.612 ' SG ' ' N ' ' B' ' 3' ' ' ASP . 0.0 OUTLIER 70.09 -77.92 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.781 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.612 ' N ' ' SG ' ' B' ' 2' ' ' CYS . 0.4 OUTLIER -139.65 36.45 2.01 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.88 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.525 ' NH1' HE22 ' B' ' 19' ' ' GLN . 0.1 OUTLIER -104.81 -89.34 0.42 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.684 179.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.632 ' HG2' ' H ' ' B' ' 6' ' ' ALA . 22.8 tttt 76.62 -152.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.724 179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.075 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 52.74 175.85 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.183 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.748 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 59.0 t -147.83 71.12 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.727 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.793 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -34.8 140.32 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.521 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.748 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 3.2 mmtp -115.27 -25.58 7.97 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.213 179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -140.83 -87.97 0.17 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.165 179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 1.066 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 62.64 106.31 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.856 -0.611 . . . . 0.0 112.095 179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 -109.28 24.32 13.26 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.648 178.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.761 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -107.82 173.31 6.38 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.166 -0.925 . . . . 0.0 111.044 -179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.761 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.2 OUTLIER -54.61 128.0 30.44 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.856 179.931 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.613 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 1.7 mm-40 -39.85 -64.5 0.48 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.872 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -50.36 -27.45 6.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.385 -0.37 . . . . 0.0 110.548 179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.647 ' HB2' ' O ' ' B' ' 14' ' ' SER . 0.0 OUTLIER -75.55 -31.61 60.12 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.701 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 1.054 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -71.29 -36.2 71.59 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.395 179.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.556 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 20.1 mt-30 -74.82 -35.57 62.44 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 179.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -74.88 -34.91 62.29 Favored 'General case' 0 N--CA 1.451 -0.375 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.617 178.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.856 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 1.4 t -65.19 -42.49 93.56 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.756 179.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.964 HG22 ' CD2' ' B' ' 76' ' ' PHE . 91.2 t -60.94 -50.0 82.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.332 179.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.556 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 20.7 mt-10 -53.75 -38.61 64.58 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.945 -0.571 . . . . 0.0 110.297 179.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.598 ' SG ' ' CE1' ' B' ' 46' ' ' PHE . 71.9 m -65.71 -38.46 89.27 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.011 179.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.805 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -68.77 -30.2 68.75 Favored 'General case' 0 CA--C 1.512 -0.488 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.412 ' H ' ' HG1' ' B' ' 26' ' ' THR . 0.7 OUTLIER -72.43 -40.2 67.27 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 114.361 -1.291 . . . . 0.0 109.926 178.787 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.857 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -56.86 -43.77 81.51 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.855 -0.612 . . . . 0.0 109.892 179.354 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 1.061 ' HB3' HG23 ' B' ' 38' ' ' ILE . . . -73.51 -34.29 65.18 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.423 179.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.805 HD12 ' O ' ' B' ' 25' ' ' ALA . 2.3 mt -65.53 -40.82 93.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.876 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -84.96 -18.52 34.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 -179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 1.1 mmmm -83.38 -21.14 33.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.85 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.822 ' CB ' HD13 ' B' ' 34' ' ' ILE . 0.1 OUTLIER -153.01 -49.0 0.1 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.792 -179.921 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.611 ' C ' HD12 ' B' ' 34' ' ' ILE . 3.4 t-20 83.37 28.42 0.09 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.777 -179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.822 HD13 ' CB ' ' B' ' 32' ' ' TYR . 1.1 mp -111.2 140.76 29.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.736 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.854 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -53.91 -70.91 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.897 0.379 . . . . 0.0 110.62 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.527 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -54.18 -55.86 23.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.89 179.855 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.609 ' CB ' ' HB ' ' B' ' 34' ' ' ILE . 12.3 t0 -47.4 -60.74 2.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.723 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 1.061 HG23 ' HB3' ' B' ' 28' ' ' ALA . 26.6 mt -46.88 -60.66 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.982 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.764 ' CB ' ' HB2' ' A' ' 65' ' ' TYR . . . -40.94 -46.1 2.72 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 0.0 110.562 179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.819 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -63.08 -62.93 1.37 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.406 179.356 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.857 ' NE2' ' HB3' ' B' ' 27' ' ' GLN . 0.8 OUTLIER -39.23 -42.3 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.59 179.483 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.783 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 7.9 mt -72.47 -70.14 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.256 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.831 ' NZ ' HG23 ' B' ' 53' ' ' THR . 27.9 tttp -36.97 -48.02 0.74 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.642 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 6.5 mttt -62.39 -56.03 22.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.261 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.777 ' O ' ' HG3' ' B' ' 48' ' ' LYS . 0.5 OUTLIER -57.01 -58.32 8.67 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.831 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.856 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -40.57 -64.24 0.55 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.958 179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.789 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 2.8 p30 -46.4 -42.41 15.09 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.844 -179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.777 ' HG3' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -69.93 -36.87 75.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.865 -179.379 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.466 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.35 -9.66 46.9 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.693 -179.212 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.753 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 92.8 m-85 -127.5 -70.05 0.72 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.454 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.753 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 5.7 t-20 161.06 109.45 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.176 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.035 -179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.789 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 96.8 Cg_exo -43.53 154.65 0.2 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 122.344 2.029 . . . . 0.0 112.479 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.831 HG23 ' NZ ' ' B' ' 43' ' ' LYS . 6.1 m -119.2 134.62 55.11 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 122.927 0.491 . . . . 0.0 110.652 0.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.789 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 45.0 m95 -100.12 125.71 46.26 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.293 -0.412 . . . . 0.0 112.055 -179.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.727 ' HB2' ' O ' ' B' ' 86' ' ' PHE . 62.8 m170 -93.77 94.76 8.72 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 177.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.726 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.7 OUTLIER -102.52 151.39 22.37 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.991 0.737 . . . . 0.0 112.991 -177.37 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 1.06 HG13 HD23 ' B' ' 84' ' ' LEU . 13.7 mm -139.83 155.82 25.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 114.641 -1.163 . . . . 0.0 109.386 178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 0.816 HG23 HG11 ' B' ' 81' ' ' VAL . 1.5 p -162.11 109.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-O 120.93 0.395 . . . . 0.0 111.59 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.841 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -136.23 -123.28 2.26 Favored Glycine 0 N--CA 1.447 -0.582 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.832 179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.425 HH11 ' HD2' ' B' ' 60' ' ' ARG . 0.8 OUTLIER -166.09 -23.88 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.45 0 CA-C-O 120.57 0.224 . . . . 0.0 111.523 179.907 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.607 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 1.5 m-20 -157.61 46.25 0.37 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.824 0.345 . . . . 0.0 111.282 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.849 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.2 p90 -102.88 175.08 5.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.938 179.832 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.585 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.79 87.43 0.41 Allowed Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.375 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.994 ' HA ' HD12 ' A' ' 57' ' ' ILE . 10.9 p -85.21 121.64 28.25 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.958 0.409 . . . . 0.0 111.105 -179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.852 ' HE2' ' HD2' ' A' ' 43' ' ' LYS . 11.6 t80 -134.18 61.33 1.68 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.629 179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.942 HG13 HD11 ' A' ' 57' ' ' ILE . 17.5 m -96.7 164.65 2.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.16 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.671 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 93.5 m -101.7 98.93 9.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.013 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.861 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER -43.36 169.85 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.023 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.717 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.8 OUTLIER -142.13 -119.78 0.1 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.99 -179.969 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.568 ' C ' ' H ' ' B' ' 72' ' ' HIS . 41.5 p -39.4 -98.4 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.014 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' B' ' 13' ' ' MET . 3.4 mmmm -68.74 18.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.77 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.861 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 20.1 m170 65.78 -88.16 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.944 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.765 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 2.4 p90 165.74 -176.26 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.0 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 1.066 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -156.67 114.63 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.545 179.305 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.811 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 1.3 t80 -100.4 137.71 38.45 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.918 178.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.964 ' CD2' HG22 ' B' ' 22' ' ' VAL . 1.0 OUTLIER -162.62 156.83 21.17 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.824 0.345 . . . . 0.0 111.376 -179.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 2.1 t80 -116.89 112.61 21.29 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.292 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.075 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 4.1 mm? -69.92 170.31 11.46 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.639 179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.5 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -28.5 -36.29 0.01 OUTLIER Glycine 0 C--N 1.331 0.291 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.497 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.615 ' O ' HG23 ' B' ' 81' ' ' VAL . 0.4 OUTLIER -158.62 44.35 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.921 0.391 . . . . 0.0 110.694 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.841 HG13 ' O ' ' B' ' 59' ' ' GLY . 37.7 t -160.02 169.36 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.036 -179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.606 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -135.88 111.13 9.01 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.344 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.781 ' HB ' ' CZ ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -98.64 133.61 40.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-O 121.157 0.503 . . . . 0.0 112.012 -179.191 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 1.06 HD23 HG13 ' B' ' 57' ' ' ILE . 0.4 OUTLIER -118.85 94.39 4.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.486 -0.779 . . . . 0.0 109.768 179.423 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.765 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 0.5 OUTLIER -98.24 135.7 39.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.076 0.465 . . . . 0.0 111.637 -179.031 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.727 ' O ' ' HB2' ' B' ' 55' ' ' HIS . 9.3 p90 -174.43 121.03 0.26 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.84 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.789 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -90.49 161.51 15.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.885 0.374 . . . . 0.0 110.923 179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.717 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.5 OUTLIER -117.76 21.23 13.04 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.338 0.59 . . . . 0.0 110.486 179.774 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.151 0 CA-C-O 118.325 -1.264 . . . . 0.0 112.504 -179.806 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.6 ptt? . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.872 0.368 . . . . 0.0 111.111 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 2.4 t 75.61 -56.92 0.59 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.896 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.47 -174.61 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.87 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.43 ' CD ' ' N ' ' A' ' 4' ' ' ARG . 1.0 OUTLIER -67.85 -73.87 0.13 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.087 -179.828 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt 68.76 -163.27 0.19 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.965 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.975 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.41 153.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.408 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.75 HG12 ' HE2' ' A' ' 9' ' ' LYS . 92.4 t -118.66 71.12 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.834 179.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.877 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -35.63 137.02 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.754 -179.834 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.75 ' HE2' HG12 ' A' ' 7' ' ' VAL . 12.0 mmtt -125.82 -11.26 6.64 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.647 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.56 ' O ' ' HE1' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -168.52 87.12 0.2 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.799 -179.833 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.668 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -121.91 109.42 14.61 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.911 0.386 . . . . 0.0 111.685 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.64 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 2.7 m-20 -112.23 30.66 6.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.123 179.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.781 ' H ' HE22 ' A' ' 18' ' ' GLN . 11.3 ttp -117.89 171.05 8.33 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.761 -179.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.729 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 4.0 m -53.55 134.62 40.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.028 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.655 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.8 tm-20 -45.99 -68.27 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.93 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.718 ' HA ' ' NE2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -44.49 -27.33 0.44 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.831 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.645 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.79 -50.03 16.41 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.541 179.677 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.973 ' HB3' HG13 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -58.72 -26.83 64.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.481 179.738 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.718 ' NE2' ' HA ' ' A' ' 16' ' ' GLU . 4.2 pt20 -77.85 -45.29 24.74 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 179.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.441 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 36.5 m-20 -67.4 -26.53 66.49 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.437 -0.801 . . . . 0.0 109.563 178.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.946 ' OG ' HD22 ' A' ' 85' ' ' LEU . 28.8 t -68.0 -52.57 34.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.612 179.1 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.837 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 47.5 t -54.5 -47.7 70.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.41 179.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.48 -35.81 72.76 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.95 179.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.923 ' SG ' HG23 ' A' ' 42' ' ' ILE . 10.2 t -67.29 -35.4 79.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.101 -0.499 . . . . 0.0 109.986 179.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.748 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -72.86 -33.99 66.47 Favored 'General case' 0 CA--C 1.513 -0.459 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.303 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.603 ' HA ' HD12 ' A' ' 29' ' ' LEU . 2.4 m -69.62 -37.32 76.78 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 114.413 -1.267 . . . . 0.0 109.441 178.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.523 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 2.7 mt-30 -61.78 -41.73 98.09 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.855 179.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.77 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -79.5 -17.4 54.2 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.138 178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.658 HD12 ' C ' ' A' ' 25' ' ' ALA . 5.5 mt -80.97 -37.01 30.05 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.971 179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -87.21 -26.96 23.27 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.249 -179.391 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.523 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 0.1 OUTLIER -85.07 -23.6 28.48 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.951 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.601 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -144.29 -161.2 1.23 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.89 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.644 ' C ' HD13 ' A' ' 34' ' ' ILE . 5.5 t-20 -166.32 28.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.613 179.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.042 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.4 mm -118.39 103.42 14.62 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.665 179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.669 ' HA ' HD12 ' A' ' 38' ' ' ILE . 1.0 OUTLIER -26.33 -77.58 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 121.012 0.434 . . . . 0.0 110.821 179.992 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.529 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -40.36 -42.15 1.51 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.905 179.436 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 1.042 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -64.89 -58.75 5.34 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.659 179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.913 ' HB ' HG11 ' A' ' 58' ' ' VAL . 3.8 mt -46.82 -48.42 7.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.82 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.997 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.56 -38.86 82.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.867 179.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.801 ' HA ' ' CD1' ' B' ' 65' ' ' TYR . . . -59.85 -67.71 0.36 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.015 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.674 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -50.39 -49.96 52.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.824 179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.923 HG23 ' SG ' ' A' ' 24' ' ' CYS . 98.2 mt -49.99 -67.25 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.167 -179.925 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.807 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 4.5 tmtt? -51.25 -40.75 59.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.855 179.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.582 ' N ' ' HD3' ' A' ' 43' ' ' LYS . 1.1 tppt? -54.39 -57.37 11.56 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.015 0.436 . . . . 0.0 110.736 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.542 ' O ' ' N ' ' A' ' 49' ' ' LYS . 5.3 mt-10 -54.0 -54.57 37.22 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.644 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.789 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.7 m-85 -52.23 -46.75 65.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.867 179.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.807 ' HB3' ' HE2' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -72.81 -12.54 61.03 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.292 -179.708 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.423 ' HB3' ' HE2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -123.66 13.21 9.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.739 0.304 . . . . 0.0 111.259 -179.724 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.542 ' N ' ' O ' ' A' ' 45' ' ' GLU . 6.0 ttmm -129.96 -31.61 1.92 Allowed 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.189 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.682 ' CD2' ' HA ' ' A' ' 46' ' ' PHE . 60.0 m-85 -109.82 -57.23 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.074 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.78 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 0.0 OUTLIER 160.83 114.22 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.433 -179.789 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.714 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 16.5 Cg_endo -57.16 165.92 4.82 Favored 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 122.355 2.037 . . . . 0.0 112.455 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.717 HG21 HG21 ' B' ' 67' ' ' THR . 1.2 m -108.66 124.89 51.23 Favored 'General case' 0 C--N 1.343 0.305 0 C-N-CA 122.974 0.509 . . . . 0.0 110.361 -0.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.75 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.5 m95 -96.89 160.84 14.13 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.376 0.607 . . . . 0.0 111.996 -179.329 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.823 ' HD2' ' HA ' ' A' ' 87' ' ' LYS . 0.0 OUTLIER -152.43 111.98 3.93 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.056 -0.974 . . . . 0.0 109.079 179.352 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.926 ' HB2' HD12 ' A' ' 85' ' ' LEU . 13.7 p -120.3 151.61 38.96 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -178.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.033 HD11 HG13 ' B' ' 66' ' ' VAL . 20.8 mm -126.03 118.36 51.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.444 179.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.997 HG12 ' HB2' ' A' ' 39' ' ' ALA . 2.4 p -113.04 124.03 69.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 120.816 0.341 . . . . 0.0 111.069 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.6 ' O ' ' HB3' ' A' ' 82' ' ' ALA . . . -157.9 173.84 35.2 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.675 -0.774 . . . . 0.0 112.275 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.5 OUTLIER -137.7 40.05 2.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.678 0.275 . . . . 0.0 111.295 -179.632 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.466 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER 167.89 28.8 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.919 179.828 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.878 ' HE1' ' HB3' ' A' ' 64' ' ' SER . 15.7 p90 -117.0 -172.32 2.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.163 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.811 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.63 102.49 0.27 Allowed Glycine 0 N--CA 1.451 -0.351 0 CA-C-N 115.617 -0.72 . . . . 0.0 111.737 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.967 ' CB ' HD12 ' B' ' 57' ' ' ILE . 63.6 p -84.87 138.22 32.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.063 0.459 . . . . 0.0 111.731 -179.217 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.823 ' CD1' ' HA ' ' B' ' 40' ' ' ALA . 54.8 t80 -153.32 89.63 1.37 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.034 179.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.743 HG12 ' N ' ' B' ' 56' ' ' CYS . 6.2 m -135.18 -161.44 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.203 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.869 ' HB ' HG21 ' B' ' 53' ' ' THR . 0.7 OUTLIER -99.88 -161.16 0.85 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.794 179.895 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.713 ' HB2' ' O ' ' A' ' 72' ' ' HIS . 38.4 p-80 -168.42 122.53 0.9 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.804 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.545 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -130.83 157.89 41.66 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.511 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 74.94 -85.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.047 179.923 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.538 ' O ' ' HB2' ' A' ' 13' ' ' MET . 28.7 mttt -109.96 14.44 23.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.002 -179.956 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.713 ' O ' ' HB2' ' A' ' 68' ' ' HIS . 6.7 m170 71.64 -86.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.752 179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.694 ' HB3' ' HB2' ' A' ' 86' ' ' PHE . 1.8 p90 162.3 -167.27 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.436 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.973 HG13 ' HB3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -165.39 110.61 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-O 120.994 0.426 . . . . 0.0 111.673 -179.995 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.749 ' O ' ' HA ' ' A' ' 8' ' ' ILE . 0.9 OUTLIER -100.39 138.06 37.97 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.079 179.198 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.972 ' CE1' HD13 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -159.22 132.97 7.4 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.979 -179.589 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.611 ' HA ' ' O ' ' A' ' 81' ' ' VAL . 18.7 t80 -98.95 102.37 14.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.798 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.975 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.2 mm? -55.82 170.02 0.31 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.763 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.486 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.89 -33.25 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.661 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.572 ' N ' ' O ' ' A' ' 78' ' ' LEU . 0.4 OUTLIER -160.08 39.84 0.18 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.849 0.357 . . . . 0.0 111.094 -179.812 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.616 HG12 ' N ' ' A' ' 82' ' ' ALA . 81.3 t -156.95 165.31 1.01 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.746 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.662 ' C ' HD13 ' A' ' 83' ' ' ILE . . . -125.82 140.97 52.23 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.553 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.662 HD13 ' C ' ' A' ' 82' ' ' ALA . 0.0 OUTLIER -134.18 130.73 54.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-O 120.979 0.418 . . . . 0.0 111.446 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.814 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 0.1 OUTLIER -120.35 97.7 5.7 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.851 179.61 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.946 HD22 ' OG ' ' A' ' 21' ' ' SER . 1.4 mp -99.65 124.34 44.78 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.61 -178.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.694 ' HB2' ' HB3' ' A' ' 73' ' ' PHE . 3.0 p90 -166.04 140.79 4.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.29 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.823 ' HA ' ' HD2' ' A' ' 55' ' ' HIS . 15.8 mtpt -90.24 -147.18 0.19 Allowed 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.593 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.674 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.6 OUTLIER -166.21 18.96 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.386 0.612 . . . . 0.0 110.473 179.681 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.414 -1.214 . . . . 0.0 112.552 179.954 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.716 ' O ' ' HG2' ' B' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.872 0.368 . . . . 0.0 111.184 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.45 ' O ' ' CB ' ' B' ' 3' ' ' ASP . 0.0 OUTLIER -164.17 150.3 11.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.86 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.546 ' OD1' ' N ' ' B' ' 3' ' ' ASP . 0.4 OUTLIER 164.64 -161.12 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.908 -179.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.59 ' O ' ' HB3' ' B' ' 5' ' ' LYS . 1.9 tpp85 30.94 -104.41 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.056 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.59 ' HB3' ' O ' ' B' ' 4' ' ' ARG . 0.7 OUTLIER 79.32 31.04 0.29 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.667 -179.757 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -128.46 -165.94 1.56 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.454 -179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.576 ' N ' ' O ' ' B' ' 77' ' ' TYR . 87.7 t -154.08 75.24 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.195 -179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.789 HD12 ' HB3' ' B' ' 76' ' ' PHE . 1.3 mp -34.69 140.46 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 120.866 0.365 . . . . 0.0 110.266 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.475 ' HE3' ' HB3' ' B' ' 77' ' ' TYR . 7.0 mmtp -119.55 -11.32 9.48 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.769 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.636 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 1.2 t-20 -168.7 -94.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.392 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.896 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 80.41 -179.67 0.09 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.598 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.473 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.4 m-20 177.15 35.26 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.694 179.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.808 ' H ' ' NE2' ' B' ' 18' ' ' GLN . 19.6 ttp -130.87 167.66 18.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.386 -0.825 . . . . 0.0 110.838 -179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.591 ' O ' ' HB2' ' B' ' 17' ' ' MET . 0.0 OUTLIER -48.63 131.3 17.7 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.82 179.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.474 ' CA ' ' HG2' ' B' ' 18' ' ' GLN . 1.7 mp0 -40.99 -64.92 0.48 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.671 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 1.1 mm-40 -46.32 -35.96 5.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.305 179.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.779 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 43.9 mmm -68.34 -33.72 74.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.049 179.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 1.015 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.7 OUTLIER -73.54 -33.74 64.85 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.137 179.232 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.739 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 13.1 pt20 -78.0 -36.36 48.88 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.582 179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.664 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 1.0 OUTLIER -76.53 -31.64 57.76 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.323 178.623 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.1 OUTLIER -67.88 -49.13 63.74 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 115.435 -0.802 . . . . 0.0 109.861 179.036 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.949 HG23 ' O ' ' B' ' 18' ' ' GLN . 48.6 t -59.47 -42.94 89.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.228 179.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.739 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 2.2 mt-10 -60.71 -34.33 74.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.079 179.275 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 47.1 m -68.85 -38.5 79.83 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.118 179.268 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.799 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -68.98 -28.23 66.43 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 178.45 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.565 ' HA ' HD12 ' B' ' 29' ' ' LEU . 4.2 m -72.05 -37.74 69.63 Favored 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.64 178.516 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.743 ' O ' ' HD3' ' B' ' 31' ' ' LYS . 44.2 mt-30 -59.14 -45.71 90.24 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.454 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.93 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -75.81 -20.37 58.23 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.486 179.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.839 ' CD2' HG21 ' B' ' 81' ' ' VAL . 4.8 mt -76.42 -45.1 33.06 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.054 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.29 -23.74 37.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.992 -179.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.743 ' HD3' ' O ' ' B' ' 27' ' ' GLN . 1.3 mttp -84.93 -33.52 22.69 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.731 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.632 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -141.03 -175.94 4.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.63 179.857 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -145.97 34.82 1.01 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.892 0.377 . . . . 0.0 110.842 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 1.014 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.5 mm -120.23 103.82 14.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.084 -179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.811 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 1.8 mp0 -29.57 -64.67 0.11 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.841 0.353 . . . . 0.0 110.698 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.5 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 11.9 mmmt -50.86 -54.75 21.22 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.076 179.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 1.014 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 2.4 m-20 -54.69 -61.62 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.962 0.41 . . . . 0.0 110.567 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.93 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 9.9 mt -41.15 -45.64 0.73 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.757 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 1.037 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -64.83 -45.59 85.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.721 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.823 ' HA ' ' CD1' ' A' ' 65' ' ' TYR . . . -54.35 -57.09 12.58 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.949 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.766 ' CE1' ' HB3' ' B' ' 37' ' ' ASP . 0.1 OUTLIER -54.55 -40.47 68.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.97 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.73 HG13 ' O ' ' B' ' 38' ' ' ILE . 49.1 mt -64.5 -68.89 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.101 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.67 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -40.56 -43.04 1.8 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.79 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.615 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 3.9 mtpp -62.56 -54.31 41.61 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.099 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 10.4 mt-10 -64.69 -25.1 67.8 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 116.013 -0.539 . . . . 0.0 111.075 -179.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -76.96 -46.41 24.2 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.921 0.391 . . . . 0.0 110.882 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.787 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.3 p30 -66.76 -24.68 66.24 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.477 179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.447 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -89.94 -42.34 11.24 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.057 -179.775 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.521 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -80.27 -14.56 58.3 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.36 -179.584 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.664 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 43.5 m-85 -131.11 -71.16 0.58 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.358 -179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.665 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 0.5 OUTLIER 157.39 118.9 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.192 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.44 -179.564 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.787 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 26.6 Cg_endo -61.52 170.14 5.87 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.512 2.141 . . . . 0.0 112.347 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.869 HG21 ' HB ' ' A' ' 67' ' ' THR . 1.9 m -101.91 136.83 41.07 Favored 'General case' 0 C--N 1.343 0.287 0 C-N-CA 123.044 0.538 . . . . 0.0 110.612 0.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.783 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 56.4 m95 -107.92 105.45 15.25 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.505 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.792 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 5.9 m170 -78.25 93.83 4.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.987 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.3 OUTLIER -108.5 140.62 41.58 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.357 0.599 . . . . 0.0 112.589 -178.017 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.987 HD13 ' O ' ' B' ' 56' ' ' CYS . 19.1 mm -135.56 103.45 3.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 115.185 -0.916 . . . . 0.0 109.913 178.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.037 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.5 p -103.52 125.41 58.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.678 -179.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.745 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -144.2 -110.62 0.73 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.971 -0.633 . . . . 0.0 111.959 179.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.685 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 6.9 ptt180 168.74 3.57 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 178.8 29.79 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.683 0.277 . . . . 0.0 111.461 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.875 ' HE2' ' HB3' ' B' ' 64' ' ' SER . 2.9 p90 -92.96 -167.34 1.71 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.055 0.455 . . . . 0.0 110.832 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.574 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -139.94 86.11 0.21 Allowed Glycine 0 N--CA 1.448 -0.537 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.833 179.861 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.895 ' CA ' HD12 ' A' ' 57' ' ' ILE . 5.8 p -82.33 122.51 28.06 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.065 0.46 . . . . 0.0 111.32 -179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.801 ' CD1' ' HA ' ' A' ' 40' ' ' ALA . 46.6 t80 -133.44 83.53 2.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.426 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 1.033 HG13 HD11 ' A' ' 57' ' ' ILE . 7.5 m -118.85 150.34 21.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.282 -179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.717 HG21 HG21 ' A' ' 53' ' ' THR . 18.4 m -73.18 77.87 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.603 179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.465 ' HB2' ' CB ' ' B' ' 73' ' ' PHE . 29.4 p-80 -59.59 169.01 1.42 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.821 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 178.11 173.54 0.61 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.931 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.489 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 1.6 m 75.81 -89.33 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.826 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.789 ' HE2' ' CE1' ' B' ' 72' ' ' HIS . 0.5 OUTLIER 166.53 43.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.794 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.789 ' CE1' ' HE2' ' B' ' 71' ' ' LYS . 84.9 m-70 -138.85 31.25 2.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.899 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.794 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 7.6 t80 -111.8 79.36 1.21 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.566 179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 1.015 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -102.87 123.88 56.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.173 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.71 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.3 OUTLIER -111.91 137.02 50.46 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.344 179.645 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.805 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 8.0 p90 -161.18 168.33 24.43 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.982 -179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.652 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 47.1 t80 -133.92 115.49 14.47 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.873 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.96 170.1 11.95 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.619 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.502 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.09 -48.07 0.05 OUTLIER Glycine 0 C--N 1.331 0.253 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.733 -179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.453 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -146.45 38.78 1.05 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.877 0.37 . . . . 0.0 110.747 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.839 HG21 ' CD2' ' B' ' 29' ' ' LEU . 76.5 t -152.25 167.67 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.961 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.738 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -134.32 143.18 47.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.701 179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.799 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.3 OUTLIER -135.5 128.9 48.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-O 120.996 0.427 . . . . 0.0 111.212 -179.842 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.779 ' O ' ' HA ' ' B' ' 56' ' ' CYS . 0.1 OUTLIER -121.15 96.83 5.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.521 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.967 HD12 ' HB3' ' B' ' 56' ' ' CYS . 1.8 mp -100.09 117.86 35.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.959 -179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.953 ' CE2' HG21 ' B' ' 66' ' ' VAL . 1.0 OUTLIER -150.99 126.59 10.18 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.923 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.783 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.6 OUTLIER -103.7 152.76 21.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.82 179.88 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.792 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -111.16 17.64 20.14 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.255 0.55 . . . . 0.0 110.628 179.819 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . 0.471 ' C ' ' O ' ' B' ' 88' ' ' SER . . . . . . . . 0 C--O 1.249 1.093 0 CA-C-O 118.419 -1.212 . . . . 0.0 112.622 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.575 ' SD ' ' N ' ' A' ' 2' ' ' CYS . 5.4 tpp . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.836 0.35 . . . . 0.0 111.151 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.575 ' N ' ' SD ' ' A' ' 1' ' ' MET . 0.5 OUTLIER 43.09 -171.44 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.863 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.406 ' HB3' ' H ' ' A' ' 4' ' ' ARG . 7.5 m-20 -112.48 -136.63 0.37 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.004 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.643 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.4 OUTLIER 74.49 -66.82 0.28 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.98 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 67.04 -168.31 0.2 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.817 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 61.62 166.6 0.1 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.646 179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.645 HG12 ' O ' ' A' ' 7' ' ' VAL . 65.2 t -134.52 71.51 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.767 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.865 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -31.86 152.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.947 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.585 ' HE2' ' O ' ' A' ' 8' ' ' ILE . 0.4 OUTLIER -142.81 -11.63 0.77 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.501 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.47 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER 179.63 103.88 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.53 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.674 ' CB ' HG13 ' A' ' 74' ' ' ILE . . . -140.02 130.03 24.88 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.561 -179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.616 ' HB2' ' HB3' ' A' ' 72' ' ' HIS . 27.4 m-20 -121.17 24.15 10.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.304 179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.673 ' HG3' ' H ' ' A' ' 14' ' ' SER . 17.0 ttp -104.01 170.47 7.9 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.668 -0.696 . . . . 0.0 110.794 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.703 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 0.3 OUTLIER -46.82 138.86 5.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.9 -179.98 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.615 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 24.9 mp0 -50.26 -64.78 0.7 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.613 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.442 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 6.4 tt0 -58.21 -16.72 14.82 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.974 0.416 . . . . 0.0 110.097 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.703 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -81.75 -39.15 24.59 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.669 179.61 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.992 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -67.16 -37.94 84.62 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.113 179.521 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.643 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 4.4 mt-30 -75.21 -36.29 61.41 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.532 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 2.1 m-20 -69.5 -35.11 75.23 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.549 178.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.802 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 1.2 t -64.22 -45.37 88.54 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.664 -0.698 . . . . 0.0 109.728 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.659 HG13 ' HB2' ' A' ' 6' ' ' ALA . 69.5 t -55.97 -51.13 64.58 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.279 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.327 179.2 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -56.93 -34.18 67.73 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.278 179.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.588 ' HB3' HG23 ' A' ' 42' ' ' ILE . 0.5 OUTLIER -68.88 -34.35 75.29 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.694 179.131 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.822 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -72.33 -38.39 68.65 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 178.291 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.504 ' HA ' HD12 ' A' ' 29' ' ' LEU . 34.2 m -67.3 -38.06 84.4 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 114.229 -1.351 . . . . 0.0 109.711 178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.786 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -58.65 -44.31 90.08 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.73 -0.668 . . . . 0.0 109.512 178.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.863 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -72.57 -26.69 61.81 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.698 178.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.822 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.6 mt -74.19 -35.82 63.99 Favored 'General case' 0 N--CA 1.454 -0.242 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.851 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -77.94 -28.82 49.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.399 179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.786 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 25.5 mmtt -85.2 -33.71 22.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.209 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.589 ' CE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.4 140.8 16.7 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.503 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -104.75 29.95 5.83 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.107 -179.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.742 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 39.7 mm -104.92 110.22 30.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.063 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.56 ' HA ' HD12 ' A' ' 38' ' ' ILE . 7.3 mp0 -27.5 -85.83 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.025 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.488 ' HG3' HG22 ' A' ' 34' ' ' ILE . 2.0 pttt -39.13 -34.45 0.17 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.904 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.742 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 49.2 t0 -66.37 -50.88 62.03 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.069 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.95 HG22 HD11 ' A' ' 42' ' ' ILE . 5.7 mt -58.84 -43.68 88.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.903 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 1.012 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -60.23 -39.58 87.18 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.705 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.797 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -65.55 -63.29 1.13 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.605 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.863 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -42.77 -62.54 0.98 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.478 179.531 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.95 HD11 HG22 ' A' ' 38' ' ' ILE . 16.4 mt -45.42 -66.15 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.356 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.658 ' HB3' ' CE2' ' B' ' 65' ' ' TYR . 0.6 OUTLIER -42.25 -66.23 0.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.938 -179.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.537 ' N ' ' HD2' ' A' ' 43' ' ' LYS . 5.0 tptp -36.61 -54.09 0.88 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.672 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -57.88 -68.82 0.21 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.728 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.802 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.3 m-85 -37.63 -53.31 1.22 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.94 179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.691 ' OD1' ' HG3' ' A' ' 52' ' ' PRO . 4.5 t70 -54.97 -37.32 66.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.868 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.488 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -104.88 11.96 33.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.804 179.85 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 2.8 mmmt -131.12 11.58 5.05 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.279 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.611 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 77.8 m-85 -157.58 -63.17 0.09 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.63 0.253 . . . . 0.0 111.487 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.611 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.0 OUTLIER 164.17 107.87 0.02 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 116.532 -0.303 . . . . 0.0 110.58 -179.644 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.691 ' HG3' ' OD1' ' A' ' 47' ' ' ASP . 82.5 Cg_exo -47.27 152.23 2.32 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 122.37 2.046 . . . . 0.0 112.43 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 1.014 HG21 HG21 ' B' ' 67' ' ' THR . 91.0 m -117.88 133.31 56.05 Favored 'General case' 0 C--N 1.343 0.318 0 C-N-CA 123.08 0.552 . . . . 0.0 110.557 -0.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.837 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.5 m95 -97.44 143.93 27.67 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.173 0.511 . . . . 0.0 111.784 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.757 ' HB3' ' CB ' ' B' ' 66' ' ' VAL . 0.3 OUTLIER -131.93 112.76 12.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.558 -0.746 . . . . 0.0 109.278 179.08 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.975 ' HB2' HD12 ' A' ' 85' ' ' LEU . 4.4 p -124.84 154.35 41.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.37 0.605 . . . . 0.0 112.596 -178.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.113 HG21 HG21 ' B' ' 57' ' ' ILE . 12.3 mm -131.15 113.22 23.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.234 178.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.012 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.5 p -105.02 128.99 58.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-O 121.019 0.437 . . . . 0.0 111.184 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.736 ' HA3' ' CD1' ' A' ' 62' ' ' PHE . . . -157.99 170.13 34.8 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 120.995 -0.621 . . . . 0.0 111.783 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.536 ' HB3' ' HA ' ' A' ' 81' ' ' VAL . 0.0 OUTLIER -132.84 34.82 3.6 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.956 0.408 . . . . 0.0 110.887 -179.792 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.509 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 1.1 t-20 169.63 27.34 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.68 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.982 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 20.7 p90 -115.52 -169.83 1.65 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.036 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.906 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.35 95.6 0.17 Allowed Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 121.056 -0.592 . . . . 0.0 111.916 179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.976 ' CB ' HD12 ' B' ' 57' ' ' ILE . 20.0 p -80.99 140.5 35.17 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.979 0.419 . . . . 0.0 111.539 -179.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.825 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 71.8 t80 -149.13 93.23 2.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.283 179.696 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.947 HG21 ' CD2' ' A' ' 86' ' ' PHE . 4.1 m -133.1 149.35 31.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.702 -179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.929 HG21 HG21 ' B' ' 53' ' ' THR . 1.6 t -79.58 147.31 32.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.679 179.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 1.044 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -100.92 155.03 18.19 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.22 -179.833 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.664 ' HG3' ' OG ' ' A' ' 88' ' ' SER . 0.0 OUTLIER -129.65 -82.48 0.56 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.045 179.889 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.551 ' C ' ' H ' ' A' ' 72' ' ' HIS . 36.2 m -66.0 -107.34 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.941 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.586 ' HG3' ' HG3' ' A' ' 13' ' ' MET . 0.0 OUTLIER -69.87 31.04 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.9 179.973 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 1.044 ' HA ' ' HB2' ' A' ' 68' ' ' HIS . 1.1 m80 56.61 -91.36 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.636 -179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.78 ' HB2' ' O ' ' A' ' 85' ' ' LEU . 0.1 OUTLIER 161.59 -174.34 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.718 179.756 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.992 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -154.92 131.76 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.265 -179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.538 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 2.3 t80 -120.61 133.39 55.38 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.071 178.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.865 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 0.3 OUTLIER -151.66 164.73 36.29 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.94 0.4 . . . . 0.0 111.113 -179.516 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.601 ' O ' ' HD1' ' A' ' 77' ' ' TYR . 4.0 t80 -122.92 92.53 3.73 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.964 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.8 mm? -48.12 166.35 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.692 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.516 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -24.47 -54.93 0.05 OUTLIER Glycine 0 C--N 1.331 0.301 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.99 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -136.72 12.15 3.17 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.015 0.436 . . . . 0.0 110.693 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.843 HG12 ' H ' ' A' ' 82' ' ' ALA . 21.8 t -129.58 179.64 3.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.502 -179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.843 ' H ' HG12 ' A' ' 81' ' ' VAL . . . -141.19 143.51 34.25 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.726 0.298 . . . . 0.0 110.67 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.783 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.3 OUTLIER -130.96 125.78 58.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.92 0.391 . . . . 0.0 111.739 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.91 HD23 HG12 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -113.12 96.98 6.22 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.115 179.51 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.975 HD12 ' HB2' ' A' ' 56' ' ' CYS . 1.7 mp -95.6 128.89 42.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.892 0.377 . . . . 0.0 111.494 -179.31 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.947 ' CD2' HG21 ' A' ' 66' ' ' VAL . 0.2 OUTLIER -159.84 119.67 2.93 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.989 179.493 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.837 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -111.69 149.67 31.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.13 -0.487 . . . . 0.0 111.047 -179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.717 ' HB2' ' HE1' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -111.44 18.59 19.02 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.326 0.584 . . . . 0.0 110.587 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.376 -1.236 . . . . 0.0 112.485 -179.958 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.839 0.352 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -153.11 166.85 31.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.892 179.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 56.17 86.66 0.06 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.06 -179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.407 ' HD3' HH11 ' B' ' 4' ' ' ARG . 0.0 OUTLIER -178.84 4.66 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.038 179.866 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.642 ' O ' ' HB2' ' B' ' 6' ' ' ALA . 0.0 OUTLIER -47.74 118.51 2.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.763 179.873 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.936 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.67 -179.22 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.765 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.705 HG23 ' O ' ' B' ' 77' ' ' TYR . 41.2 t -145.06 63.46 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.859 179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.921 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.5 OUTLIER -33.49 148.61 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.442 -179.845 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.588 ' HG2' ' O ' ' B' ' 8' ' ' ILE . 13.9 mmtt -148.21 -1.86 0.54 Allowed 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.929 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.483 ' HB3' ' HB2' ' B' ' 75' ' ' TYR . 0.3 OUTLIER -175.22 83.09 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.761 179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.752 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -123.7 113.51 18.72 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.831 -179.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.901 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 94.7 m-20 -110.65 37.7 2.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.935 -0.575 . . . . 0.0 109.984 179.064 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 17' ' ' MET . 17.3 ttp -125.68 170.97 11.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.075 -179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.712 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.44 141.84 14.84 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.827 179.877 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.661 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 17.7 mp0 -50.89 -60.53 2.98 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.896 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 1.3 mt-10 -54.24 -20.73 7.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.536 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.727 ' SD ' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -82.67 -34.57 27.36 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.866 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 1.036 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.69 -36.97 68.0 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.823 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.763 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 3.2 mp0 -77.06 -40.72 45.16 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 179.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.519 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 5.0 m-20 -67.05 -34.01 76.77 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.468 178.858 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.853 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -65.5 -46.65 78.87 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.034 179.104 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.845 HG22 ' CD2' ' B' ' 76' ' ' PHE . 73.3 t -56.28 -42.38 73.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.305 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.242 179.161 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.763 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 24.1 mt-10 -60.6 -39.4 87.99 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.333 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.539 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 4.1 t -66.51 -32.97 74.66 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.976 0.417 . . . . 0.0 110.097 179.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.78 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -73.22 -32.15 64.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 178.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.977 ' HA ' HD12 ' B' ' 29' ' ' LEU . 90.1 m -72.43 -39.53 67.78 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 114.312 -1.313 . . . . 0.0 109.639 178.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.789 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 80.7 mm-40 -58.11 -46.1 86.13 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.315 178.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.997 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -67.93 -29.09 68.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.843 178.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.988 HD11 ' HG ' ' B' ' 78' ' ' LEU . 4.5 mt -65.36 -57.11 9.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.664 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.84 -34.48 71.61 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.803 179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.789 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 16.0 mmtt -79.83 -28.78 40.1 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.676 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.552 ' HE1' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -167.56 133.63 2.09 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.183 -179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.404 ' ND2' ' H ' ' B' ' 33' ' ' ASN . 2.4 p30 -97.47 26.25 5.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.564 179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 1.019 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 10.3 mm -95.84 109.98 23.59 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.743 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.906 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 0.5 OUTLIER -29.73 -70.37 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.116 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.616 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -50.67 -56.52 11.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.916 0.388 . . . . 0.0 110.557 179.859 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 1.019 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -43.99 -64.17 0.72 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.541 179.806 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.997 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 7.0 mt -45.49 -52.96 2.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.671 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.911 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -51.4 -39.16 56.65 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.646 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.825 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -66.89 -63.38 1.07 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.573 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.672 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.5 OUTLIER -42.84 -47.34 5.54 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.518 179.672 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.78 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 32.5 mt -61.74 -70.44 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.393 -179.738 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.766 ' HB3' ' CE2' ' A' ' 65' ' ' TYR . 0.5 OUTLIER -36.49 -58.98 0.68 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.14 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.478 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 1.6 tttm -51.38 -42.28 61.28 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.54 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.771 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -70.45 -42.25 71.74 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.358 -179.458 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.853 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -63.56 -35.78 81.63 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.014 -179.911 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.801 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -68.84 -46.43 68.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.698 -179.781 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.4 ' N ' ' CG ' ' B' ' 47' ' ' ASP . 0.1 OUTLIER -78.16 -25.49 47.3 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.219 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.771 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -89.7 -16.9 29.38 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.122 -179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.749 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 53.6 m-85 -125.93 -72.01 0.67 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.455 -179.687 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.749 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 52.7 t30 160.09 108.55 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.228 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.801 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 62.4 Cg_exo -35.02 157.23 0.02 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.562 2.174 . . . . 0.0 112.63 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.929 HG21 HG21 ' A' ' 67' ' ' THR . 0.3 OUTLIER -121.92 120.13 33.56 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 122.809 0.444 . . . . 0.0 110.611 -0.005 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.836 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 33.8 m95 -88.69 155.29 19.68 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.278 0.561 . . . . 0.0 111.491 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.815 ' CE1' HG22 ' A' ' 67' ' ' THR . 3.7 m-70 -136.03 99.11 4.05 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.265 -0.88 . . . . 0.0 108.888 179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.998 ' O ' HD13 ' B' ' 57' ' ' ILE . 2.3 m -108.08 151.51 25.77 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 -177.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 1.113 HG21 HG21 ' A' ' 57' ' ' ILE . 18.1 mm -135.46 108.15 8.68 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 CA-C-N 115.058 -0.974 . . . . 0.0 109.629 178.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 0.911 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.1 p -111.1 125.78 68.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -178.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.894 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -146.63 -96.1 0.18 Allowed Glycine 0 N--CA 1.449 -0.466 0 CA-C-N 115.721 -0.672 . . . . 0.0 112.196 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.627 ' HB3' ' O ' ' B' ' 59' ' ' GLY . 16.5 ptt85 169.27 -27.82 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.54 0 CA-C-O 120.813 0.339 . . . . 0.0 111.088 -179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.475 ' O ' ' OD1' ' B' ' 61' ' ' ASN . 24.4 t-20 -160.47 42.41 0.18 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.202 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.982 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.6 p90 -96.65 -165.02 1.21 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.875 0.369 . . . . 0.0 110.784 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.522 ' HA3' ' HB3' ' A' ' 35' ' ' GLU . . . -141.08 111.57 0.72 Allowed Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.805 -0.712 . . . . 0.0 111.795 179.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.955 ' CA ' HD12 ' A' ' 57' ' ' ILE . 88.4 p -101.1 128.32 47.23 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.084 0.469 . . . . 0.0 111.596 -179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.797 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 48.0 t80 -136.41 67.62 1.45 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.494 -0.775 . . . . 0.0 110.143 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.861 HG13 HD11 ' A' ' 57' ' ' ILE . 10.3 m -103.28 169.86 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.376 -179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 1.014 HG21 HG21 ' A' ' 53' ' ' THR . 59.6 m -117.34 80.64 1.52 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.71 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.834 ' HE1' ' HB ' ' B' ' 70' ' ' THR . 59.7 t-80 -57.37 -129.19 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.945 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.574 ' N ' ' ND1' ' B' ' 68' ' ' HIS . 6.7 pt-20 161.32 -47.23 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.027 -179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.834 ' HB ' ' HE1' ' B' ' 68' ' ' HIS . 4.0 m -87.73 -111.7 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.613 -179.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.584 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -56.97 4.26 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.66 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.901 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 0.1 OUTLIER 72.4 -74.77 0.08 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.64 0.257 . . . . 0.0 110.549 -179.879 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.767 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 4.3 p90 154.94 173.02 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.215 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 1.036 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -147.17 119.28 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.922 0.391 . . . . 0.0 111.246 179.511 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.764 ' O ' ' HA ' ' B' ' 8' ' ' ILE . 1.4 t80 -103.79 136.55 43.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.351 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.921 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.8 OUTLIER -159.38 129.19 5.54 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.975 -179.898 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.705 ' O ' HG23 ' B' ' 7' ' ' VAL . 2.4 t80 -97.16 113.38 24.96 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.991 -179.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 0.988 ' HG ' HD11 ' B' ' 29' ' ' LEU . 0.9 OUTLIER -69.47 170.54 10.34 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.42 179.554 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.506 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.54 -41.55 0.01 OUTLIER Glycine 0 C--N 1.33 0.242 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.958 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.521 ' N ' ' O ' ' B' ' 78' ' ' LEU . 51.6 mt-30 -154.02 35.4 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.753 0.311 . . . . 0.0 110.826 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.894 HG13 ' O ' ' B' ' 59' ' ' GLY . 58.6 t -151.16 170.91 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.024 -179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.942 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.61 154.13 46.54 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.299 179.735 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.942 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -142.71 126.57 14.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-O 120.979 0.418 . . . . 0.0 111.56 -179.652 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 1.04 HD23 HG12 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -118.57 95.71 4.97 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.201 179.439 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.936 HD12 ' HB3' ' B' ' 56' ' ' CYS . 1.7 mp -93.65 123.74 37.18 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.368 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.756 ' CD1' HG21 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -162.53 123.23 2.48 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.558 179.653 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.836 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 2.2 ptmt -100.59 143.78 30.35 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.956 0.407 . . . . 0.0 110.974 -179.782 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.502 ' H ' ' CD2' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -107.23 18.92 21.06 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.321 0.581 . . . . 0.0 110.48 179.66 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.027 0 CA-C-O 118.4 -1.222 . . . . 0.0 112.431 -179.946 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.5 mmt . . . . . 0 N--CA 1.485 1.294 0 CA-C-O 120.849 0.356 . . . . 0.0 111.298 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.485 ' O ' ' C ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -104.29 -112.59 0.24 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.913 -179.942 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.485 ' C ' ' O ' ' A' ' 2' ' ' CYS . 3.9 p30 31.81 47.98 0.09 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.88 0.372 . . . . 0.0 110.683 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.644 ' NE ' ' HG2' ' A' ' 19' ' ' GLN . 23.7 mmt180 -46.78 -50.69 17.85 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.237 -179.813 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.484 ' O ' ' O ' ' A' ' 6' ' ' ALA . 8.1 mmmm 60.55 -167.28 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.652 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.081 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 56.72 144.86 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.216 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.506 HG12 ' HE2' ' A' ' 9' ' ' LYS . 21.4 t -107.69 78.29 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.969 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.995 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -46.38 154.42 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-O 121.051 0.453 . . . . 0.0 110.607 179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.506 ' HE2' HG12 ' A' ' 7' ' ' VAL . 5.6 mmtt -138.53 -19.4 1.07 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.725 -0.671 . . . . 0.0 110.27 179.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.485 HD22 ' HA ' ' A' ' 10' ' ' ASN . 0.0 OUTLIER -168.27 98.09 0.43 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.535 179.969 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.85 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -112.13 75.47 0.92 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.748 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.757 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 7.4 m-20 -75.17 38.54 0.13 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.251 0.548 . . . . 0.0 109.618 179.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.871 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -136.26 172.12 13.47 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.626 -179.113 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.871 ' N ' ' HG2' ' A' ' 13' ' ' MET . 8.3 t -54.24 134.74 44.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.285 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.777 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -51.36 -78.95 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.337 -179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.497 ' HG2' ' N ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -43.33 -27.42 0.25 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.979 0.419 . . . . 0.0 110.352 -179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.835 ' HG2' ' CG ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -78.71 -35.06 45.45 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.047 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.85 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -74.58 -31.62 62.12 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-O 120.818 0.342 . . . . 0.0 110.398 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.644 ' HG2' ' NE ' ' A' ' 4' ' ' ARG . 1.6 mt-30 -72.28 -40.9 67.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 178.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 16.1 m-20 -66.65 -29.67 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.529 178.573 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.727 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -66.58 -45.61 78.7 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.049 179.081 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.764 HG22 ' CD2' ' A' ' 76' ' ' PHE . 84.7 t -57.88 -48.57 83.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.477 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.406 ' OE2' ' OD1' ' A' ' 3' ' ' ASP . 13.2 mm-40 -58.15 -36.84 73.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.953 0.406 . . . . 0.0 110.081 179.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 42.8 t -67.37 -32.68 73.77 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.047 179.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.766 ' C ' HD12 ' A' ' 29' ' ' LEU . . . -73.56 -40.27 64.06 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 178.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.874 ' HA ' HD12 ' A' ' 29' ' ' LEU . 87.1 m -64.55 -37.71 88.49 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 114.271 -1.332 . . . . 0.0 109.43 178.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 19.2 mm-40 -61.26 -43.09 99.44 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.493 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.795 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -76.69 -14.5 59.95 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.996 179.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.874 HD12 ' HA ' ' A' ' 26' ' ' THR . 2.4 mt -82.53 -44.99 15.24 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.777 179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.75 -34.51 64.77 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.241 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.499 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 3.1 mttm -79.13 -28.65 42.89 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.649 -179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.636 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -153.68 149.07 27.14 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.94 179.593 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -116.37 33.53 5.5 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.053 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.976 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 5.7 mm -112.95 107.86 24.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.964 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.916 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 35.5 mp0 -29.95 -74.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.904 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.505 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -43.54 -59.46 2.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.691 179.767 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.976 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -45.2 -63.39 0.95 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.544 179.751 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.795 HG23 ' CB ' ' A' ' 28' ' ' ALA . 7.5 mt -46.79 -52.22 4.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.126 179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 1.076 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -54.16 -36.7 63.64 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.101 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.805 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -66.23 -67.28 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.115 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.689 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -46.14 -39.93 10.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 179.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.754 HG13 ' O ' ' A' ' 38' ' ' ILE . 65.6 mt -62.8 -66.52 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.966 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.892 ' HE3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -46.61 -47.05 20.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.501 179.74 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.448 ' O ' ' HB3' ' A' ' 47' ' ' ASP . 0.8 OUTLIER -52.85 -63.47 1.13 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.99 0.424 . . . . 0.0 110.453 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.677 ' HA ' ' OE1' ' A' ' 45' ' ' GLU . 4.5 tp10 -45.61 -58.02 3.74 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.378 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.727 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 2.1 m-85 -52.93 -39.72 63.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.594 179.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.799 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 3.9 t70 -62.12 -24.96 67.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.064 -0.517 . . . . 0.0 110.345 179.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.805 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -118.4 4.76 11.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.799 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.625 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -107.74 -14.22 14.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.938 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.797 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 5.6 m-85 -145.51 -63.14 0.33 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.24 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.797 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 10.7 p-10 157.0 117.16 0.0 OUTLIER Pre-proline 0 C--N 1.333 -0.149 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.148 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.799 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 13.8 Cg_endo -56.18 174.82 0.29 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.47 2.113 . . . . 0.0 112.22 -179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.798 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 23.4 m -103.66 123.16 46.48 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 123.14 0.576 . . . . 0.0 110.577 0.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.817 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 51.5 m95 -96.77 126.95 42.29 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.18 0.514 . . . . 0.0 112.181 -179.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.749 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -106.82 96.99 6.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 108.863 -0.791 . . . . 0.0 108.863 178.504 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.939 ' O ' HD13 ' A' ' 57' ' ' ILE . 18.9 p -111.4 147.08 35.99 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -178.199 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.963 ' CG1' HD23 ' A' ' 84' ' ' LEU . 18.3 mm -133.03 109.67 14.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.304 178.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.076 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.1 p -109.42 124.62 66.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.823 0.344 . . . . 0.0 111.796 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.84 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -146.65 -135.76 2.78 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.957 -0.639 . . . . 0.0 112.061 179.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -160.89 -20.26 0.05 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.749 0.309 . . . . 0.0 111.312 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.708 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 8.8 m-20 -154.91 35.37 0.39 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.355 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.917 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 11.2 p90 -101.66 -178.29 3.68 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.71 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.815 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -136.73 107.59 0.61 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.907 -0.663 . . . . 0.0 111.82 179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.889 ' CB ' HD12 ' B' ' 57' ' ' ILE . 53.6 p -92.41 130.37 38.11 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.207 0.527 . . . . 0.0 111.713 -179.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.808 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 48.5 t80 -136.67 72.06 1.42 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.099 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.046 HG13 HD11 ' B' ' 57' ' ' ILE . 5.9 m -122.38 136.53 58.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.294 -179.544 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 1.055 HG21 HG21 ' B' ' 53' ' ' THR . 7.0 t -67.94 116.78 8.98 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.972 179.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.46 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 21.4 p-80 -87.21 162.83 17.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.736 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.517 ' O ' HG23 ' A' ' 70' ' ' THR . 6.3 pt-20 -158.57 -153.28 0.37 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.949 0.404 . . . . 0.0 111.166 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.517 HG23 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 44.06 -92.61 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.908 180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.772 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 170.64 21.02 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.659 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.851 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 25.5 m-70 -125.18 61.96 1.18 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.12 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.757 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 7.4 t80 -130.76 97.82 4.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.093 -0.503 . . . . 0.0 109.933 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.926 HG23 ' HE1' ' A' ' 76' ' ' PHE . 0.1 OUTLIER -115.42 122.88 70.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.804 -179.163 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.593 ' HD1' ' HA ' ' A' ' 84' ' ' LEU . 8.0 t80 -114.04 137.11 52.15 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.299 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.995 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -161.0 173.23 15.55 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.989 0.423 . . . . 0.0 111.183 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.706 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 89.2 t80 -132.87 92.47 3.05 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.908 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.081 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 4.1 mm? -42.75 169.15 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.852 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.59 -44.14 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.424 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.443 ' O ' ' OE1' ' A' ' 80' ' ' GLN . 0.9 OUTLIER -148.37 32.62 0.81 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.984 0.421 . . . . 0.0 110.645 179.815 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.84 HG13 ' O ' ' A' ' 59' ' ' GLY . 76.4 t -147.46 171.66 3.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.65 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.711 ' C ' HD13 ' A' ' 83' ' ' ILE . . . -133.51 144.79 49.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.82 0.343 . . . . 0.0 110.745 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.711 HD13 ' C ' ' A' ' 82' ' ' ALA . 0.2 OUTLIER -134.53 124.64 45.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.077 -179.752 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.963 HD23 ' CG1' ' A' ' 57' ' ' ILE . 0.9 OUTLIER -112.72 88.34 2.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.556 -179.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.79 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -93.35 124.19 37.16 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.472 -179.554 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.749 ' CE1' ' HB2' ' A' ' 55' ' ' HIS . 2.5 p90 -164.11 129.04 2.8 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.591 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.798 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.53 161.59 13.75 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.503 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.668 ' HB2' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -120.22 19.64 12.14 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.305 0.574 . . . . 0.0 110.434 179.551 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.029 0 CA-C-O 118.39 -1.228 . . . . 0.0 112.556 -179.987 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.474 ' O ' ' C ' ' B' ' 2' ' ' CYS . 14.3 mtt . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.8 0.333 . . . . 0.0 111.197 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.474 ' C ' ' O ' ' B' ' 1' ' ' MET . 0.0 OUTLIER 31.9 76.4 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.991 179.855 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -58.72 141.16 53.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.617 179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.558 HH11 ' CB ' ' B' ' 19' ' ' GLN . 0.0 OUTLIER 61.19 87.24 0.09 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.682 179.982 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.529 ' O ' ' HD2' ' B' ' 5' ' ' LYS . 0.0 OUTLIER -112.02 40.52 2.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.147 -179.759 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.088 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -115.42 -170.92 1.86 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.336 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.782 HG12 ' HE3' ' B' ' 9' ' ' LYS . 26.8 t -137.98 66.69 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.804 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.801 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 0.9 OUTLIER -37.21 157.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.132 0.491 . . . . 0.0 110.663 -179.829 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.782 ' HE3' HG12 ' B' ' 7' ' ' VAL . 0.1 OUTLIER -154.44 -11.4 0.13 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.201 179.722 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.519 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.2 OUTLIER -166.8 100.34 0.56 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.433 179.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.843 ' HB1' ' NE2' ' B' ' 18' ' ' GLN . . . -128.77 136.77 50.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.019 0.438 . . . . 0.0 111.599 -179.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.572 ' CB ' ' HD2' ' B' ' 68' ' ' HIS . 21.1 t70 -132.63 28.7 4.26 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.705 -0.68 . . . . 0.0 109.774 179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.824 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 13.5 ttp -123.98 151.58 43.5 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.856 -179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.783 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 2.1 m -36.52 141.39 0.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.942 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.468 ' O ' ' CG ' ' B' ' 18' ' ' GLN . 11.9 mt-10 -46.94 -66.45 0.4 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-O 121.006 0.431 . . . . 0.0 111.184 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.706 ' O ' ' HG2' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -50.93 -30.57 15.15 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.773 -179.908 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.796 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.13 -40.75 74.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.743 179.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.843 ' NE2' ' HB1' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -66.78 -28.67 68.58 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.849 0.357 . . . . 0.0 110.469 179.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.706 ' HG2' ' O ' ' B' ' 16' ' ' GLU . 2.6 pt20 -77.36 -42.55 36.08 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 179.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.625 ' N ' ' HG3' ' B' ' 19' ' ' GLN . 1.1 m-20 -69.9 -25.03 63.49 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.79 179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.827 ' OG ' HG21 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -70.87 -51.52 25.86 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.196 179.278 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.818 ' HA ' ' CZ ' ' B' ' 76' ' ' PHE . 60.9 t -57.17 -42.39 79.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.244 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.561 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 8.7 mt-10 -61.42 -38.88 88.73 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.077 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.421 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 65.9 m -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.964 179.196 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.76 ' C ' HD12 ' B' ' 29' ' ' LEU . . . -70.23 -33.63 71.88 Favored 'General case' 0 CA--C 1.513 -0.469 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 178.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.581 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 1.4 m -66.84 -40.76 88.05 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 114.43 -1.259 . . . . 0.0 109.487 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 5.6 mt-30 -56.57 -44.92 81.46 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.562 178.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.729 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -80.25 -15.23 57.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.565 179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.886 HD21 HG11 ' B' ' 81' ' ' VAL . 5.7 mt -82.57 -35.71 26.9 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.08 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.641 ' OE1' ' HD2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -88.07 -30.19 20.08 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.188 -179.717 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.641 ' HD2' ' OE1' ' B' ' 30' ' ' GLU . 1.7 mptt -84.39 -9.75 58.15 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.834 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.611 ' HD1' ' O ' ' B' ' 28' ' ' ALA . 0.1 OUTLIER -151.1 -150.09 0.33 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.975 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.494 HD22 ' HA ' ' B' ' 33' ' ' ASN . 0.0 OUTLIER 177.87 28.02 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.609 179.843 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 1.037 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.8 mm -117.8 106.4 19.81 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.509 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.815 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 2.3 mp0 -29.67 -62.65 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.924 0.392 . . . . 0.0 110.731 -179.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.626 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -55.1 -51.97 64.71 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.017 179.651 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 1.037 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.5 m-20 -54.44 -61.3 2.4 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.828 -179.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.875 ' HB ' HG11 ' B' ' 58' ' ' VAL . 2.5 mt -45.78 -48.85 4.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.008 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 1.034 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -62.42 -34.2 76.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.0 179.778 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.808 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -62.4 -62.91 1.43 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.034 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.608 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -53.72 -54.13 42.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.939 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.765 HD11 HG22 ' B' ' 38' ' ' ILE . 73.7 mt -44.06 -66.65 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.277 -179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.712 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 13.2 tttp -42.82 -50.97 5.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.903 0.382 . . . . 0.0 110.917 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.529 ' HZ2' ' HB3' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -55.9 -45.9 78.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.219 -179.79 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.686 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.0 mt-10 -68.09 -34.88 77.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.15 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.788 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -72.32 -32.63 66.71 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.991 -179.901 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.733 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 5.1 m-20 -71.31 -38.0 71.77 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.915 179.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.48 -23.67 20.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.688 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.686 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.4 OUTLIER -86.03 -20.53 28.68 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.359 -179.562 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.555 ' HD2' ' O ' ' B' ' 46' ' ' PHE . 12.7 m-85 -132.09 -66.82 0.69 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.643 -0.253 . . . . 0.0 111.617 -179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.492 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 3.4 t-20 158.93 118.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.395 -179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.733 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 20.8 Cg_endo -60.3 171.61 3.11 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.307 2.005 . . . . 0.0 112.333 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 1.055 HG21 HG21 ' A' ' 67' ' ' THR . 62.9 m -104.74 131.57 52.02 Favored 'General case' 0 C--N 1.343 0.313 0 C-N-CA 122.917 0.487 . . . . 0.0 111.052 0.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.826 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 46.2 m95 -102.2 157.58 16.79 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.591 -179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.771 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 10.2 m-70 -128.91 99.57 5.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.339 -0.846 . . . . 0.0 108.755 178.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.665 ' O ' HD13 ' B' ' 57' ' ' ILE . 1.8 m -106.26 128.26 53.84 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -177.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 1.046 HD11 HG13 ' A' ' 66' ' ' VAL . 17.0 mm -125.32 101.38 8.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.501 178.138 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.034 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.7 p -108.77 126.24 65.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 121.075 0.464 . . . . 0.0 111.85 -178.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.771 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -144.08 -105.29 0.5 Allowed Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.795 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.842 ' HG3' HD22 ' B' ' 61' ' ' ASN . 0.4 OUTLIER 170.91 -33.26 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.475 0 CA-C-O 120.67 0.271 . . . . 0.0 111.194 179.84 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.842 HD22 ' HG3' ' B' ' 60' ' ' ARG . 7.0 m-80 -145.02 46.72 1.33 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.125 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.917 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 21.3 p90 -111.0 -173.54 2.27 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 120.904 0.383 . . . . 0.0 110.76 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.916 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -138.0 98.53 0.26 Allowed Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.778 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.916 ' CA ' HD12 ' A' ' 57' ' ' ILE . 1.2 p -86.81 121.99 30.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.223 0.535 . . . . 0.0 111.591 -179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.892 ' HE2' ' HE3' ' A' ' 43' ' ' LYS . 21.8 t80 -129.14 75.53 1.66 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.463 -0.79 . . . . 0.0 110.45 179.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.791 HG13 HD11 ' A' ' 57' ' ' ILE . 28.4 m -123.48 164.62 20.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.336 -179.504 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.593 HG21 HG21 ' A' ' 53' ' ' THR . 5.3 t -82.91 128.17 34.19 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.669 179.852 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.572 ' HD2' ' CB ' ' B' ' 12' ' ' ASP . 1.8 p-80 -104.11 118.57 36.97 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.968 -179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.557 ' O ' ' HB ' ' B' ' 70' ' ' THR . 0.8 OUTLIER -123.29 168.73 12.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.707 179.87 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.557 ' HB ' ' O ' ' B' ' 69' ' ' GLU . 29.0 m 76.13 -100.15 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.716 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.631 ' O ' ' HA ' ' B' ' 13' ' ' MET . 2.3 ttpt 173.33 38.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.798 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.826 ' HB3' ' CZ3' ' B' ' 54' ' ' TRP . 3.2 m-70 -138.66 46.87 1.97 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.963 179.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.794 ' HA ' ' O ' ' B' ' 85' ' ' LEU . 4.8 t80 -120.69 87.67 2.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.404 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.827 HG21 ' OG ' ' B' ' 21' ' ' SER . 1.2 tt -105.48 144.91 14.32 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.045 0.45 . . . . 0.0 111.632 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.519 ' N ' ' O ' ' B' ' 10' ' ' ASN . 0.8 OUTLIER -134.1 131.18 38.44 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.195 179.145 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.818 ' CZ ' ' HA ' ' B' ' 22' ' ' VAL . 9.7 p90 -158.54 161.7 37.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.991 0.425 . . . . 0.0 111.258 -179.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.737 ' O ' HG23 ' B' ' 7' ' ' VAL . 8.0 t80 -122.23 111.02 16.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.411 179.556 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.088 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.6 mm? -69.41 169.97 11.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.339 -0.392 . . . . 0.0 110.767 -179.635 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -23.39 -45.8 0.01 OUTLIER Glycine 0 C--N 1.332 0.326 0 CA-C-N 116.162 -0.472 . . . . 0.0 113.15 -179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.581 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 14.3 tt0 -151.4 36.74 0.59 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.752 0.311 . . . . 0.0 110.937 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.886 HG11 HD21 ' B' ' 29' ' ' LEU . 86.0 t -152.12 170.18 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.184 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.824 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -133.85 149.94 51.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.824 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -140.11 131.56 31.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.188 -179.964 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.982 HD23 ' CG1' ' B' ' 57' ' ' ILE . 2.0 tp -121.34 88.58 2.96 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.682 179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.794 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 1.3 mp -92.93 124.54 36.99 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.069 -179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.783 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 12.1 p90 -162.72 132.83 4.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.349 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.799 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.5 OUTLIER -93.82 151.87 19.3 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.534 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.687 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.1 OUTLIER -113.99 19.72 16.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.314 0.578 . . . . 0.0 110.17 179.541 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.397 -1.224 . . . . 0.0 112.436 -179.866 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.4 mtm . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.831 0.348 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 14.1 m 57.74 108.97 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.815 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.562 ' HB3' HH11 ' A' ' 4' ' ' ARG . 1.2 m-20 -149.1 -145.83 0.18 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.088 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.562 HH11 ' HB3' ' A' ' 3' ' ' ASP . 0.0 OUTLIER -33.65 -60.11 0.38 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.206 -179.881 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.414 ' O ' HD13 ' A' ' 78' ' ' LEU . 6.1 tptm 52.74 35.83 19.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.793 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.043 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -136.5 175.3 9.73 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.212 179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.522 ' O ' ' HE3' ' A' ' 9' ' ' LYS . 95.9 t -137.31 77.94 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.758 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.808 HD12 ' HB3' ' A' ' 76' ' ' PHE . 1.2 mp -32.78 148.3 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.334 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.774 ' HB2' ' CD2' ' A' ' 75' ' ' TYR . 5.0 mmtp -129.45 -14.19 4.24 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.847 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 1.7 t30 -164.09 -91.56 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.483 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.993 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 70.09 -173.96 0.18 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.577 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.617 ' HB3' ' HB3' ' A' ' 72' ' ' HIS . 2.8 t0 166.62 28.51 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.471 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.648 ' HG2' ' CB ' ' A' ' 17' ' ' MET . 15.4 ttp -113.76 171.58 7.5 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.674 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.901 ' HB2' ' HG3' ' A' ' 17' ' ' MET . 1.9 m -48.35 129.17 15.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.877 -179.9 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.501 ' H ' ' HG2' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -34.39 -79.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.795 -179.996 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.64 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 2.1 mm-40 -46.07 -22.89 0.25 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.613 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.901 ' HG3' ' HB2' ' A' ' 14' ' ' SER . 0.0 OUTLIER -76.14 -39.89 53.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.549 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.835 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -68.47 -38.16 80.81 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.495 179.625 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.443 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 1.0 OUTLIER -72.98 -36.74 67.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.566 179.229 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.64 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 1.4 t0 -66.78 -39.58 87.86 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.84 179.233 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.985 ' HB2' HD22 ' A' ' 85' ' ' LEU . 1.1 p -60.35 -47.48 85.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.74 178.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.809 ' HA ' ' CE2' ' A' ' 76' ' ' PHE . 40.1 t -52.74 -50.24 42.91 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.303 179.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 54.2 mt-10 -54.3 -46.78 72.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.22 179.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.434 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 20.0 m -59.29 -37.31 77.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.034 179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.774 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.04 -28.32 66.45 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 178.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.527 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.8 m -72.93 -39.43 66.28 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.4 -1.273 . . . . 0.0 109.54 178.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.699 ' O ' ' HD3' ' A' ' 31' ' ' LYS . 6.3 mm-40 -56.79 -43.22 80.68 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.406 178.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.966 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -75.99 -29.94 58.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.178 179.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 1.074 HD21 HG11 ' A' ' 81' ' ' VAL . 3.1 mt -72.71 -30.52 64.28 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.212 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -95.96 -16.11 21.91 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.831 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.699 ' HD3' ' O ' ' A' ' 27' ' ' GLN . 0.0 OUTLIER -92.5 -23.93 18.95 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.77 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.554 ' HE1' ' HA ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -163.49 134.84 4.78 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.754 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -96.11 39.95 1.13 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.894 179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.713 ' HB ' ' CB ' ' A' ' 37' ' ' ASP . 40.2 mm -117.59 102.16 12.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.001 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.653 ' OE2' ' HD3' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -22.25 -89.43 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.423 -179.861 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.418 ' C ' ' O ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -37.03 -42.88 0.44 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.727 179.967 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.713 ' CB ' ' HB ' ' A' ' 34' ' ' ILE . 24.2 t0 -57.96 -56.54 20.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.517 179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.966 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 9.8 mt -52.04 -45.72 41.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.533 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.838 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -61.87 -45.72 92.54 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.337 179.447 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.802 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -56.2 -64.34 0.89 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.971 -0.558 . . . . 0.0 110.286 179.332 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.909 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -38.8 -52.68 1.72 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.02 179.27 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.902 HG21 HD11 ' A' ' 85' ' ' LEU . 16.9 mt -55.91 -68.17 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.203 179.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.61 ' HE2' ' C ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -37.34 -63.03 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.204 -179.848 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 tttt -43.92 -57.19 3.44 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.418 . . . . 0.0 111.037 -179.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.586 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -53.51 -57.03 12.14 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.205 -179.821 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.797 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -55.03 -34.82 63.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.554 ' HB2' ' CE ' ' A' ' 43' ' ' LYS . 17.6 t70 -73.54 -20.88 60.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.57 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.74 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -121.38 10.53 10.56 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.946 -179.953 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.586 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.8 OUTLIER -128.18 3.35 5.8 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.547 -179.431 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.58 ' HD2' ' HA ' ' A' ' 46' ' ' PHE . 95.7 m-85 -147.07 -63.12 0.29 Allowed 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.497 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 18.8 p-10 161.56 110.87 0.01 OUTLIER Pre-proline 0 C--N 1.332 -0.194 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.109 -179.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.483 ' HA ' ' HA ' ' A' ' 53' ' ' THR . 86.1 Cg_exo -45.96 151.06 1.55 Allowed 'Trans proline' 0 CA--C 1.532 0.379 0 C-N-CA 122.311 2.008 . . . . 0.0 112.578 -179.745 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.684 HG21 HG21 ' B' ' 67' ' ' THR . 95.1 m -118.74 136.17 54.11 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 123.162 0.585 . . . . 0.0 110.353 -0.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.809 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 65.3 m95 -101.48 144.8 29.81 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.27 0.557 . . . . 0.0 111.993 -179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.771 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.2 OUTLIER -130.26 103.39 6.68 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.168 -0.924 . . . . 0.0 108.847 178.854 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.851 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.37 162.64 18.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.404 0.621 . . . . 0.0 112.496 -178.176 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.993 HD12 ' HA ' ' B' ' 64' ' ' SER . 26.2 mm -131.77 172.36 16.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.977 179.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.937 HG11 ' HB ' ' A' ' 38' ' ' ILE . 7.3 p -169.33 114.59 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.946 0.403 . . . . 0.0 111.563 179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.569 ' HA2' ' CG ' ' A' ' 35' ' ' GLU . . . -141.07 -140.06 3.78 Favored Glycine 0 N--CA 1.447 -0.593 0 C-N-CA 121.024 -0.608 . . . . 0.0 111.801 179.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.653 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -162.78 6.09 0.05 OUTLIER 'General case' 0 N--CA 1.45 -0.432 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.885 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.427 ' O ' ' OE2' ' B' ' 35' ' ' GLU . 0.6 OUTLIER -179.99 32.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.76 0.314 . . . . 0.0 111.205 179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.955 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -101.12 -169.1 1.65 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.097 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.606 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -144.41 93.98 0.17 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.966 -0.635 . . . . 0.0 111.849 179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.783 ' HB3' HD13 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -82.72 134.15 35.14 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.972 0.415 . . . . 0.0 111.498 -179.244 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.761 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 19.7 t80 -143.34 65.29 1.33 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.256 179.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.813 HG21 ' CE2' ' A' ' 86' ' ' PHE . 2.8 m -113.94 153.7 15.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.357 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.607 HG22 ' CE1' ' B' ' 55' ' ' HIS . 3.4 t -62.57 -162.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.951 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.621 ' ND1' ' N ' ' A' ' 68' ' ' HIS . 0.0 OUTLIER -156.85 150.16 24.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.915 179.911 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.733 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.4 OUTLIER -143.48 175.03 10.24 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.772 179.894 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.581 ' C ' ' H ' ' A' ' 72' ' ' HIS . 3.5 m 42.37 -114.57 0.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.662 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.857 ' HG2' ' HZ3' ' A' ' 87' ' ' LYS . 4.2 mmtm -69.87 24.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.844 0.354 . . . . 0.0 110.633 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.762 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 51.1 m-70 62.54 -88.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.69 -179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.762 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 0.2 OUTLIER 162.58 -169.24 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.604 179.799 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.993 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . 1.1 tt -161.12 141.37 3.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.443 179.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.774 ' CD2' ' HB2' ' A' ' 9' ' ' LYS . 7.8 t80 -131.54 139.47 49.25 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.742 -0.663 . . . . 0.0 109.787 179.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.809 ' CE2' ' HA ' ' A' ' 22' ' ' VAL . 0.2 OUTLIER -161.55 176.42 11.06 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.845 0.355 . . . . 0.0 111.097 -179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.751 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 42.4 t80 -135.48 97.21 3.62 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.201 -179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.043 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -60.3 -169.4 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.457 179.695 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.565 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -61.73 93.08 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.562 -0.828 . . . . 0.0 112.07 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.565 ' HB2' ' O ' ' A' ' 79' ' ' GLY . 4.8 mm100 71.1 15.9 6.45 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.117 0.484 . . . . 0.0 110.268 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 1.074 HG11 HD21 ' A' ' 29' ' ' LEU . 55.2 t -136.84 164.91 29.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.775 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.814 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -138.37 151.87 47.9 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.69 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.874 ' CD1' HG23 ' A' ' 58' ' ' VAL . 0.2 OUTLIER -140.41 126.42 21.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.884 0.374 . . . . 0.0 111.398 -179.75 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.9 HD23 HG12 ' A' ' 57' ' ' ILE . 0.9 OUTLIER -112.02 93.37 4.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.985 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -92.21 147.44 22.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.173 -179.708 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.813 ' CE2' HG21 ' A' ' 66' ' ' VAL . 5.9 p90 179.33 119.02 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.182 179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.857 ' HZ3' ' HG2' ' A' ' 71' ' ' LYS . 2.3 ptmt -101.12 150.97 22.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.733 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.5 OUTLIER -103.7 20.68 17.57 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.242 0.544 . . . . 0.0 110.911 -179.847 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.559 ' HA3' ' OG1' ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.082 0 CA-C-O 118.349 -1.251 . . . . 0.0 112.364 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 17.6 mmm . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.805 0.336 . . . . 0.0 111.203 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.549 ' O ' ' NH1' ' B' ' 4' ' ' ARG . 12.1 t -107.66 67.74 0.69 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.746 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.68 ' O ' ' HD3' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -108.98 177.75 4.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.017 -179.99 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.68 ' HD3' ' O ' ' B' ' 3' ' ' ASP . 0.0 OUTLIER -175.01 -65.55 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.831 -179.987 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.498 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.6 OUTLIER 32.49 40.39 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.261 179.78 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.049 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -131.78 -176.27 3.99 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.278 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.557 ' N ' ' O ' ' B' ' 77' ' ' TYR . 45.0 t -145.73 72.41 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.922 179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.807 HD12 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -33.15 147.87 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 110.583 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.546 ' HE2' ' O ' ' B' ' 7' ' ' VAL . 0.5 OUTLIER -134.35 -12.39 2.42 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.686 -179.91 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER 173.6 103.99 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.826 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.686 ' HB1' ' HG2' ' B' ' 18' ' ' GLN . . . -130.4 154.12 48.04 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.454 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.945 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 26.6 m-20 -146.98 27.51 1.06 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.339 179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.91 ' SD ' ' HG3' ' B' ' 71' ' ' LYS . 10.7 ttp -108.26 178.02 4.62 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.571 -0.741 . . . . 0.0 110.598 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.764 ' H ' ' HG3' ' B' ' 13' ' ' MET . 3.5 m -58.76 128.6 38.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.806 0.336 . . . . 0.0 111.015 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.663 ' HA ' ' NE2' ' B' ' 18' ' ' GLN . 1.6 mt-10 -33.35 -70.06 0.08 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.882 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.747 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 3.4 mm-40 -55.22 -26.51 39.97 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.181 0.515 . . . . 0.0 110.272 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.793 ' HB3' ' HG2' ' B' ' 13' ' ' MET . 38.5 mmm -72.56 -34.67 67.64 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.54 -0.754 . . . . 0.0 110.822 179.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.96 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.41 -48.62 39.88 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.022 0.439 . . . . 0.0 110.663 179.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.768 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 2.2 mm100 -68.3 -23.43 64.73 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 178.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.779 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER -79.11 -34.89 43.03 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.153 -0.931 . . . . 0.0 109.86 179.166 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.897 ' OG ' HG21 ' B' ' 74' ' ' ILE . 0.2 OUTLIER -65.96 -41.49 91.15 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.712 -0.677 . . . . 0.0 109.883 179.075 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.887 HG22 ' CD2' ' B' ' 76' ' ' PHE . 95.4 t -63.85 -50.17 78.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.262 179.173 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.768 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 39.7 mt-10 -51.94 -40.91 61.56 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.491 179.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.744 ' HA ' ' HG3' ' B' ' 27' ' ' GLN . 48.6 t -66.7 -37.59 85.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.321 179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.749 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -69.56 -28.8 66.29 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.618 ' HA ' HD12 ' B' ' 29' ' ' LEU . 4.7 m -70.82 -43.31 68.88 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 114.329 -1.305 . . . . 0.0 109.513 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.744 ' HG3' ' HA ' ' B' ' 24' ' ' CYS . 6.1 mt-30 -53.5 -47.3 69.98 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.717 179.161 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.872 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -76.21 -20.19 57.69 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.632 179.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.734 ' CD1' ' HG ' ' B' ' 78' ' ' LEU . 5.9 mt -74.89 -39.89 61.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.958 -0.565 . . . . 0.0 111.272 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.47 -30.56 27.12 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.382 -179.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.561 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 7.2 mttt -82.04 -33.34 30.0 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.0 -179.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.622 ' CG ' ' HE1' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -144.44 157.12 44.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.788 179.952 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.642 HD22 HD13 ' B' ' 34' ' ' ILE . 0.3 OUTLIER -123.54 29.36 6.63 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.214 -179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 1.094 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 4.0 mm -107.68 108.0 24.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.592 179.485 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.7 ' O ' HG13 ' B' ' 58' ' ' VAL . 0.3 OUTLIER -29.79 -71.18 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.132 -179.512 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.52 ' HG2' ' H ' ' B' ' 36' ' ' LYS . 0.5 OUTLIER -50.03 -54.67 18.68 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.866 0.365 . . . . 0.0 110.647 179.864 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 1.094 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.3 m-20 -46.11 -64.65 0.7 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.644 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.911 ' HB ' HG11 ' B' ' 58' ' ' VAL . 4.8 mt -44.56 -56.01 0.9 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.253 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 1.006 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.88 -38.32 70.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.471 -179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.761 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -57.59 -58.83 6.59 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.218 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.684 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -58.07 -33.93 69.59 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.13 -179.82 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.767 HG13 ' O ' ' B' ' 38' ' ' ILE . 62.5 mt -66.05 -69.51 0.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.289 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.572 ' HB3' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -45.11 -37.28 4.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.962 -179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.606 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 43.3 mmtt -71.14 -51.67 23.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.948 0.404 . . . . 0.0 111.023 -179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.505 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 2.6 mt-10 -62.69 -25.58 68.23 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.947 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.805 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.2 OUTLIER -75.61 -47.49 26.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.617 179.912 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.74 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.9 OUTLIER -64.94 -24.68 67.6 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.304 179.642 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.716 ' HE2' ' C ' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -89.85 -42.76 11.06 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.625 179.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.668 ' N ' ' HG3' ' B' ' 48' ' ' LYS . 1.8 tttp -83.0 -14.17 54.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.05 -179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.779 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 58.0 m-85 -128.88 -71.38 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.435 -179.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.747 HD22 ' HD2' ' B' ' 52' ' ' PRO . 1.9 t-20 156.22 119.22 0.0 OUTLIER Pre-proline 0 CA--C 1.528 0.11 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.18 -179.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.747 ' HD2' HD22 ' B' ' 51' ' ' ASN . 19.0 Cg_endo -59.23 168.9 4.27 Favored 'Trans proline' 0 CA--C 1.534 0.486 0 C-N-CA 122.495 2.13 . . . . 0.0 112.661 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.452 HG21 HG21 ' A' ' 67' ' ' THR . 1.7 t -108.5 125.31 51.66 Favored 'General case' 0 C--N 1.345 0.404 0 C-N-CA 122.885 0.474 . . . . 0.0 110.54 0.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.808 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 42.8 m95 -95.92 168.56 10.56 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.584 0.707 . . . . 0.0 112.107 -179.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.755 ' HB3' ' CG1' ' A' ' 66' ' ' VAL . 8.4 m-70 -131.09 96.19 3.98 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.74 -1.118 . . . . 0.0 108.584 178.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.597 ' O ' ' HB1' ' B' ' 39' ' ' ALA . 78.9 m -104.44 122.49 45.62 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.201 0.524 . . . . 0.0 112.116 -178.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.783 HD13 ' HB3' ' A' ' 64' ' ' SER . 7.7 mt -127.77 109.16 19.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-N 115.448 -0.797 . . . . 0.0 110.382 179.015 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.006 HG12 ' HB2' ' B' ' 39' ' ' ALA . 1.6 p -111.04 118.65 57.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.321 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.929 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -138.79 -126.15 2.37 Favored Glycine 0 N--CA 1.448 -0.508 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.889 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.728 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -169.7 10.03 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 120.687 0.28 . . . . 0.0 111.147 -179.898 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.728 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 0.1 OUTLIER 163.64 32.82 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.994 179.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.955 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 33.2 p90 -82.86 173.08 12.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.023 0.439 . . . . 0.0 111.004 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.593 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -120.94 76.88 0.32 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.986 -0.626 . . . . 0.0 111.894 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.993 ' HA ' HD12 ' A' ' 57' ' ' ILE . 53.1 p -72.52 122.2 20.92 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.924 0.392 . . . . 0.0 111.415 -179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.802 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 23.3 t80 -133.92 77.39 1.71 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.309 179.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.969 HG21 ' CZ ' ' B' ' 86' ' ' PHE . 6.1 m -115.14 163.89 12.02 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.497 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.684 HG21 HG21 ' A' ' 53' ' ' THR . 19.7 m -95.62 73.33 3.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.464 179.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.62 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 2.9 p-80 -46.57 179.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.4 -179.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.62 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 0.0 OUTLIER -179.49 -177.53 0.43 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.467 179.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.527 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.3 OUTLIER 56.13 -120.77 1.53 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.818 -179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.91 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -70.72 17.42 0.07 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.943 0.402 . . . . 0.0 110.672 179.82 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.945 ' HB3' ' HB2' ' B' ' 12' ' ' ASP . 7.0 m-70 68.53 -90.36 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.827 -179.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.744 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 1.0 OUTLIER 157.87 -164.68 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.149 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.566 -179.971 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.96 HD12 ' CA ' ' B' ' 18' ' ' GLN . 0.2 OUTLIER -162.76 116.12 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.267 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.479 ' OH ' ' CZ ' ' B' ' 62' ' ' PHE . 1.1 t80 -107.02 134.65 49.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.29 179.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.887 ' CD2' HG22 ' B' ' 22' ' ' VAL . 2.9 p90 -152.35 165.34 35.28 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.086 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.589 ' HA ' ' O ' ' B' ' 81' ' ' VAL . 26.7 t80 -126.33 108.95 11.72 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.022 -179.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.049 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.5 OUTLIER -69.86 170.47 11.05 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.763 179.827 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.477 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.97 -37.34 0.01 OUTLIER Glycine 0 C--N 1.331 0.284 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.917 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.589 ' N ' ' O ' ' B' ' 78' ' ' LEU . 4.6 tt0 -158.5 41.97 0.26 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.745 0.307 . . . . 0.0 111.041 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.929 HG13 ' O ' ' B' ' 59' ' ' GLY . 69.8 t -157.79 164.68 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.009 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.596 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -133.44 111.74 10.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.662 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.749 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.1 OUTLIER -101.33 133.37 44.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.973 0.416 . . . . 0.0 111.482 -179.621 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.622 HD23 HG13 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -119.74 103.92 9.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.156 179.628 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.744 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 4.3 mp -107.22 117.11 33.21 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.52 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.969 ' CZ ' HG21 ' B' ' 66' ' ' VAL . 25.1 p90 -153.34 138.39 17.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.925 179.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.808 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 5.3 mtpm? -100.65 159.63 15.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 0.0 111.207 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -98.43 19.33 14.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.818 -179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . 0.409 ' CA ' ' OG1' ' B' ' 70' ' ' THR . . . . . . . . 0 C--O 1.248 1.019 0 CA-C-O 118.424 -1.209 . . . . 0.0 112.567 -179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.6 tpp . . . . . 0 N--CA 1.487 1.398 0 CA-C-O 120.728 0.299 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.611 ' HB3' ' OD1' ' A' ' 3' ' ' ASP . 0.1 OUTLIER -139.06 -64.36 0.51 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.901 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.611 ' OD1' ' HB3' ' A' ' 2' ' ' CYS . 0.0 OUTLIER -120.98 -156.51 0.68 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.931 179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.473 ' HB2' ' O ' ' A' ' 3' ' ' ASP . 2.3 mpp_? 66.67 -77.25 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.895 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.419 ' C ' HD13 ' A' ' 78' ' ' LEU . 0.1 OUTLIER 56.5 29.25 15.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.73 -179.865 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.047 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -123.9 -178.82 4.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.205 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.793 HG12 ' HE2' ' A' ' 9' ' ' LYS . 93.3 t -133.92 73.86 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.009 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.819 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.8 OUTLIER -39.59 155.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.267 179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.793 ' HE2' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -146.41 -10.03 0.49 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.567 179.98 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.442 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER 179.11 97.14 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.632 179.813 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 1.048 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -127.44 94.95 4.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.666 -179.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.464 ' O ' ' HB2' ' A' ' 72' ' ' HIS . 88.1 m-20 -90.33 30.93 1.05 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.285 179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.913 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.1 OUTLIER -116.59 166.83 11.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.644 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.89 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.0 OUTLIER -45.65 122.94 3.94 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.797 179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.636 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -38.01 -73.58 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.948 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.48 ' OE1' ' HA ' ' A' ' 16' ' ' GLU . 0.0 OUTLIER -44.52 -28.78 0.62 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.754 179.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.913 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -73.02 -43.63 61.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.812 179.89 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 1.048 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -59.9 -36.39 76.86 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.725 179.893 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.462 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 6.7 mt-30 -75.43 -39.77 58.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.137 0.494 . . . . 0.0 109.923 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.409 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.2 OUTLIER -68.48 -29.01 67.53 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.716 -0.674 . . . . 0.0 109.41 178.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.833 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.1 OUTLIER -68.53 -45.92 70.95 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.785 179.051 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 18' ' ' GLN . 17.4 t -56.55 -44.19 80.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.211 178.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.462 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 62.0 mt-10 -59.61 -41.58 90.68 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.269 179.329 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.739 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 53.6 t -65.08 -34.69 79.0 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.257 179.453 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.81 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -73.14 -32.98 65.24 Favored 'General case' 0 CA--C 1.513 -0.466 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.359 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.622 ' HA ' HD12 ' A' ' 29' ' ' LEU . 23.5 m -70.22 -36.9 74.86 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-N 114.355 -1.293 . . . . 0.0 109.565 178.583 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.815 ' HB3' ' NE2' ' A' ' 41' ' ' HIS . 0.2 OUTLIER -62.31 -42.28 99.23 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.758 179.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.92 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -69.88 -28.94 66.06 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.859 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.81 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.5 mt -71.12 -58.7 3.3 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.813 179.753 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -54.09 -36.61 63.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.859 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.788 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 15.1 mmtp -79.45 -35.77 39.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.887 -179.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.605 ' HE1' ' HB2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -153.56 152.11 30.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.886 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.93 ' HA ' HD11 ' A' ' 38' ' ' ILE . 4.7 m120 -128.46 40.37 3.67 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.534 179.916 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.707 HG22 ' O ' ' A' ' 34' ' ' ILE . 33.2 mm -107.5 49.26 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.232 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.855 ' HG3' ' HA2' ' A' ' 59' ' ' GLY . 0.0 OUTLIER 34.72 -89.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.378 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.603 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -41.33 -46.9 3.39 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.987 0.422 . . . . 0.0 110.52 179.338 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.622 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 61.0 t0 -54.19 -61.13 2.51 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.81 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.93 HD11 ' HA ' ' A' ' 33' ' ' ASN . 3.5 mt -48.12 -50.72 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.078 179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 1.031 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -52.13 -51.47 57.69 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.992 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.803 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -52.79 -51.31 61.23 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.698 179.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.851 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.6 OUTLIER -52.14 -47.0 65.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.55 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.931 HG21 HD11 ' A' ' 85' ' ' LEU . 37.1 mt -55.17 -71.88 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.189 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.784 ' HB3' ' HE2' ' B' ' 65' ' ' TYR . 0.0 OUTLIER -37.61 -55.2 1.14 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.904 -179.997 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.9 ttmt -44.26 -62.35 1.19 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.13 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.773 ' HG3' ' HG3' ' A' ' 49' ' ' LYS . 1.3 tp10 -55.54 -62.04 1.95 Allowed 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.091 -179.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.833 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.1 m-85 -41.67 -49.61 4.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.398 -0.364 . . . . 0.0 110.949 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.788 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 1.6 m-20 -56.58 -39.74 74.04 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.858 -179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -101.1 6.54 43.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.248 -179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.773 ' HG3' ' HG3' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -108.89 -20.72 12.95 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.098 -179.944 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CE2' ' CD2' ' A' ' 46' ' ' PHE . 14.1 m-85 -140.62 -58.55 0.52 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.417 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.651 ' O ' ' HE3' ' A' ' 87' ' ' LYS . 0.4 OUTLIER 159.21 118.37 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.252 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.292 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.788 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 29.3 Cg_endo -62.39 171.37 5.48 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 122.561 2.174 . . . . 0.0 112.407 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.795 HG21 HG21 ' B' ' 67' ' ' THR . 20.6 m -104.9 134.46 47.97 Favored 'General case' 0 C--N 1.344 0.353 0 C-N-CA 122.981 0.512 . . . . 0.0 110.648 0.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.807 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 45.6 m95 -105.7 145.45 31.07 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.49 -179.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.853 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 5.6 m170 -121.69 101.8 7.81 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 178.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.869 ' O ' HD13 ' A' ' 57' ' ' ILE . 8.6 p -107.66 146.79 31.56 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.542 0.571 . . . . 0.0 112.542 -178.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.087 HD12 ' HB2' ' B' ' 64' ' ' SER . 29.6 mm -134.47 107.37 9.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.548 179.003 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.031 HG12 ' HB2' ' A' ' 39' ' ' ALA . 7.2 p -107.86 116.35 51.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.545 -179.466 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.94 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -134.97 -134.11 3.35 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.796 -0.716 . . . . 0.0 112.192 179.652 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.715 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -167.36 11.12 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 120.827 0.346 . . . . 0.0 111.137 -179.841 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.715 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 29.1 t-20 165.55 31.03 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.941 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.909 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 3.0 p90 -91.32 -175.28 4.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.781 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.65 ' N ' ' HD1' ' A' ' 62' ' ' PHE . . . -138.41 101.32 0.32 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.771 -0.728 . . . . 0.0 111.87 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.98 ' CB ' HD12 ' B' ' 57' ' ' ILE . 87.6 p -87.45 144.88 26.52 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.196 0.522 . . . . 0.0 111.72 -179.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.759 ' H ' HD13 ' B' ' 57' ' ' ILE . 22.9 t80 -152.2 64.95 0.83 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.939 179.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.012 HG13 HD11 ' B' ' 57' ' ' ILE . 27.2 m -104.8 160.73 5.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.6 -179.249 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.819 HG21 HG21 ' B' ' 53' ' ' THR . 2.3 m -87.0 -17.79 32.17 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.96 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.835 ' HB3' ' HB2' ' A' ' 86' ' ' PHE . 6.4 p-80 35.55 -157.15 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.714 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' A' ' 72' ' ' HIS . 0.5 OUTLIER 167.6 -155.47 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.91 179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.533 ' HB ' ' H ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER 41.65 -98.41 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.671 -179.873 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.579 ' O ' ' HB2' ' A' ' 13' ' ' MET . 1.4 mmtp -91.27 32.83 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.712 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.726 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 0.0 OUTLIER 52.99 -88.67 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.95 -179.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.726 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 28.0 p90 165.46 -174.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.007 0.432 . . . . 0.0 111.125 -179.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 1.0 HG23 ' HE1' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -154.03 129.69 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.887 179.443 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.593 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 0.2 OUTLIER -117.05 137.23 52.39 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.496 179.644 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 1.0 ' HE1' HG23 ' A' ' 74' ' ' ILE . 0.3 OUTLIER -162.46 163.7 27.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.935 -179.902 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.767 ' HE1' ' HA ' ' A' ' 80' ' ' GLN . 6.3 t80 -130.55 103.64 6.75 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.156 -179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.047 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.0 mm? -60.21 -178.82 0.09 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.833 179.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -27.02 -53.56 0.08 OUTLIER Glycine 0 C--N 1.332 0.355 0 C-N-CA 120.949 -0.644 . . . . 0.0 112.54 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.767 ' HA ' ' HE1' ' A' ' 77' ' ' TYR . 0.3 OUTLIER -147.77 34.47 0.84 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.014 0.435 . . . . 0.0 110.415 179.468 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.94 HG13 ' O ' ' A' ' 59' ' ' GLY . 91.5 t -143.69 167.61 12.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.912 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.821 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -131.68 151.97 51.22 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.542 179.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.821 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.1 OUTLIER -138.84 134.06 42.0 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 CA-C-O 120.995 0.426 . . . . 0.0 111.375 -179.649 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.925 HD23 ' CG1' ' A' ' 57' ' ' ILE . 0.3 OUTLIER -122.5 91.65 3.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.957 179.532 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.931 HD11 HG21 ' A' ' 42' ' ' ILE . 2.1 mp -93.71 125.28 38.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.63 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.835 ' HB2' ' HB3' ' A' ' 68' ' ' HIS . 27.9 p90 -158.95 122.54 3.83 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.23 179.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.807 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 40.3 mtpt -80.4 165.44 22.23 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.615 179.594 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.853 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -115.37 19.93 15.17 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.243 0.544 . . . . 0.0 110.634 179.819 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . 0.472 ' HA2' ' OG1' ' A' ' 70' ' ' THR . . . . . . . . 0 C--O 1.249 1.085 0 CA-C-O 118.392 -1.226 . . . . 0.0 112.405 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.875 0.369 . . . . 0.0 111.179 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.458 ' HA ' ' OE2' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -130.77 40.72 3.46 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.875 179.88 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -83.99 -18.09 38.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.112 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.854 HH11 ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER 47.1 21.87 0.19 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.997 0.427 . . . . 0.0 110.723 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.644 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.1 OUTLIER -42.67 129.66 4.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.051 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.752 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.93 165.55 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.88 179.806 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.646 ' CG1' ' HE2' ' B' ' 9' ' ' LYS . 71.7 t -132.17 66.98 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.945 179.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.956 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.08 153.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-O 121.185 0.517 . . . . 0.0 110.731 -179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.748 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 0.9 OUTLIER -154.01 -4.95 0.17 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.334 179.792 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.565 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.1 OUTLIER -173.12 86.0 0.06 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.361 -179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.978 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -121.24 84.71 2.28 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.947 -179.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.531 ' O ' ' HA ' ' B' ' 71' ' ' LYS . 0.3 OUTLIER -75.9 40.57 0.2 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.952 0.406 . . . . 0.0 110.408 179.205 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.718 ' SD ' ' HA ' ' B' ' 72' ' ' HIS . 16.5 ttp -132.11 166.21 22.29 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.064 -179.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.791 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 5.0 m -52.25 143.56 14.44 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.929 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 10.9 mt-10 -48.31 -65.82 0.5 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.993 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.482 ' H ' ' HG3' ' B' ' 16' ' ' GLU . 0.1 OUTLIER -51.74 -29.25 17.93 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.852 -179.948 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.657 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -72.98 -32.04 64.93 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.988 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.86 ' NE2' ' HB1' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -76.1 -34.87 59.52 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.674 179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.676 ' HG3' ' NH1' ' B' ' 4' ' ' ARG . 2.6 mp0 -75.8 -38.28 58.35 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 179.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.36 -30.85 66.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 115.696 -0.683 . . . . 0.0 109.652 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.772 ' HA ' ' CZ ' ' B' ' 46' ' ' PHE . 77.5 p -67.77 -44.48 77.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.819 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.915 HG22 ' CD2' ' B' ' 76' ' ' PHE . 81.4 t -59.48 -50.19 80.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.477 179.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.458 ' OE2' ' HA ' ' B' ' 2' ' ' CYS . 3.7 mm-40 -55.0 -40.64 70.33 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.305 179.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 9.1 m -65.61 -35.24 80.24 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.042 -0.526 . . . . 0.0 109.813 179.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.673 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -71.8 -30.28 65.35 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 108.315 -0.994 . . . . 0.0 108.315 178.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.605 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 34.3 m -72.68 -39.35 67.12 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.593 178.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.671 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.1 OUTLIER -55.99 -45.34 79.02 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.237 178.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.69 ' CB ' HG23 ' B' ' 38' ' ' ILE . . . -76.13 -22.17 55.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.042 178.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.881 HD21 HG11 ' B' ' 81' ' ' VAL . 4.6 mt -75.46 -34.17 60.9 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.651 179.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -90.0 -25.12 21.02 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.931 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.802 ' HB2' ' CE1' ' B' ' 32' ' ' TYR . 11.8 mmtm -85.2 -27.62 26.0 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.531 179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.802 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -151.81 163.39 39.3 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.464 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.431 ' CG ' ' O ' ' B' ' 33' ' ' ASN . 28.4 t-20 -128.39 39.25 3.85 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.085 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.975 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 18.2 mm -120.54 104.41 15.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.9 179.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.727 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 0.8 OUTLIER -29.64 -66.4 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.045 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.756 ' HG3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -51.75 -50.43 60.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.791 179.877 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.975 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.6 OUTLIER -53.84 -61.99 1.94 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.905 0.383 . . . . 0.0 110.44 179.695 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.861 ' HB ' HG11 ' B' ' 58' ' ' VAL . 5.0 mt -44.46 -48.65 2.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.017 179.676 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.878 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -58.98 -43.63 91.43 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.152 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.739 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -55.58 -64.51 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.921 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.69 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -51.31 -57.17 9.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.755 HD11 HG22 ' B' ' 38' ' ' ILE . 87.8 mt -43.52 -62.67 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.003 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.679 ' HB3' ' CD2' ' A' ' 65' ' ' TYR . 4.6 tttt -53.93 -30.67 47.51 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.576 179.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' B' ' 41' ' ' HIS . 3.9 mttt -68.38 -48.55 64.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.207 -179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.466 ' O ' ' CB ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -68.11 -42.16 80.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.665 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.772 ' CZ ' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -63.26 -33.39 75.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.892 -179.922 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.785 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.7 OUTLIER -71.11 -49.22 46.6 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.96 179.972 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.403 ' HA ' ' HE3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -79.14 -21.67 46.2 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.549 -179.485 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.804 ' O ' ' HD3' ' B' ' 49' ' ' LYS . 0.4 OUTLIER -90.53 -30.26 17.37 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.609 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.559 ' HD2' ' HA ' ' B' ' 46' ' ' PHE . 87.4 m-85 -115.52 -64.48 1.31 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.747 ' O ' ' HE3' ' B' ' 87' ' ' LYS . 1.2 t-20 158.94 114.37 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.183 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 -179.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 85.1 Cg_exo -47.3 152.83 2.06 Favored 'Trans proline' 0 CA--C 1.533 0.426 0 C-N-CA 122.284 1.99 . . . . 0.0 112.659 -179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.819 HG21 HG21 ' A' ' 67' ' ' THR . 8.9 t -122.82 126.0 46.54 Favored 'General case' 0 C--N 1.343 0.285 0 C-N-CA 122.921 0.488 . . . . 0.0 111.036 0.116 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.999 ' HA ' ' HG3' ' B' ' 87' ' ' LYS . 44.5 m95 -90.62 117.16 29.07 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.747 -179.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.782 ' CE1' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -96.07 109.16 21.62 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 178.497 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 1.095 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.5 OUTLIER -123.52 149.91 44.62 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.551 0.575 . . . . 0.0 112.551 -178.354 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 1.012 HD11 HG13 ' A' ' 66' ' ' VAL . 23.2 mm -130.76 109.79 17.4 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.32 -0.855 . . . . 0.0 110.499 179.093 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 0.878 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.8 p -110.27 125.67 67.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 120.93 0.395 . . . . 0.0 111.232 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.731 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -138.37 -128.28 2.59 Favored Glycine 0 N--CA 1.448 -0.514 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.965 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.746 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 0.6 OUTLIER -165.3 5.78 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.707 0.289 . . . . 0.0 111.613 -179.844 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.746 ' HB2' ' O ' ' B' ' 60' ' ' ARG . 2.0 t-20 164.32 33.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.81 0.338 . . . . 0.0 110.974 -179.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.909 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -87.4 -171.15 3.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.043 0.449 . . . . 0.0 110.845 -179.97 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.606 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -136.97 77.58 0.34 Allowed Glycine 0 N--CA 1.45 -0.422 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.884 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 1.087 ' HB2' HD12 ' A' ' 57' ' ' ILE . 5.8 p -70.55 142.21 51.81 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.031 0.444 . . . . 0.0 111.23 -179.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.863 ' H ' HD13 ' A' ' 57' ' ' ILE . 48.8 t80 -146.04 76.42 1.45 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.356 179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.994 HG13 HD11 ' A' ' 57' ' ' ILE . 4.4 m -125.02 131.08 73.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.272 -179.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.795 HG21 HG21 ' A' ' 53' ' ' THR . 2.6 t -78.31 130.61 36.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.024 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.494 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.1 OUTLIER -72.65 177.45 4.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 -179.979 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.673 ' O ' HG23 ' B' ' 70' ' ' THR . 0.7 OUTLIER -163.97 38.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.247 -179.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.673 HG23 ' O ' ' B' ' 69' ' ' GLU . 0.1 OUTLIER 178.99 -113.95 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.134 179.8 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.535 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -158.63 25.87 0.23 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.792 -179.832 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 1.0 ' HB2' ' HB2' ' B' ' 87' ' ' LYS . 17.1 m80 -124.58 44.82 2.67 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.795 ' HA ' ' HA ' ' B' ' 86' ' ' PHE . 8.1 t80 -124.33 90.51 3.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.545 -179.901 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.978 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 0.8 OUTLIER -106.74 132.04 55.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-O 121.047 0.451 . . . . 0.0 111.508 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.699 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 18.3 t80 -119.78 134.04 55.38 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.818 179.087 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.956 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.1 OUTLIER -161.37 166.84 26.79 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.984 0.421 . . . . 0.0 111.16 -179.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.621 ' HB3' ' HB ' ' B' ' 7' ' ' VAL . 6.4 t80 -128.06 111.7 13.8 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.894 179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 0.752 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.62 166.52 18.88 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.458 179.763 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.511 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -27.43 -60.85 0.1 Allowed Glycine 0 C--N 1.332 0.344 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.502 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.81 36.15 3.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.989 0.423 . . . . 0.0 110.288 179.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.881 HG11 HD21 ' B' ' 29' ' ' LEU . 68.9 t -152.15 169.78 1.24 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.566 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.713 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -137.02 147.49 46.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.983 0.42 . . . . 0.0 110.998 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.741 HG13 ' CE2' ' B' ' 76' ' ' PHE . 0.1 OUTLIER -133.26 131.7 58.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.074 -179.812 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.971 HD23 ' CG1' ' B' ' 57' ' ' ILE . 3.3 tp -123.83 83.73 2.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.701 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 1.095 HD12 ' HB2' ' B' ' 56' ' ' CYS . 0.4 OUTLIER -87.45 131.85 34.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.007 -179.821 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.795 ' HA ' ' HA ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -160.98 125.6 3.58 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.04 179.735 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 1.0 ' HB2' ' HB2' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -105.54 143.75 33.27 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.737 179.879 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.782 ' HB2' ' CE1' ' B' ' 55' ' ' HIS . 0.5 OUTLIER -91.47 19.47 6.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.251 0.548 . . . . 0.0 110.735 179.921 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . 0.618 ' O ' ' HE2' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.447 -1.196 . . . . 0.0 112.511 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.586 ' C ' ' SG ' ' A' ' 2' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.789 0.328 . . . . 0.0 111.203 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.586 ' SG ' ' C ' ' A' ' 1' ' ' MET . 0.2 OUTLIER -165.29 83.55 0.36 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.797 179.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 169.61 166.53 0.05 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.841 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.564 ' NH2' HE21 ' A' ' 19' ' ' GLN . 0.0 OUTLIER -57.08 -76.32 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.066 -179.829 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.413 ' HD2' ' HA ' ' A' ' 5' ' ' LYS . 0.4 OUTLIER 66.05 28.61 10.34 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.683 -179.695 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.075 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.61 169.19 12.74 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.879 -0.6 . . . . 0.0 111.229 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.564 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 47.6 t -120.96 82.8 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.786 179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.904 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.4 OUTLIER -55.18 136.52 17.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 121.117 0.484 . . . . 0.0 110.639 -179.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.564 ' HE2' ' CG1' ' A' ' 7' ' ' VAL . 0.5 OUTLIER -125.19 -12.85 6.84 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.041 179.603 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.6 ' O ' ' N ' ' A' ' 75' ' ' TYR . 29.9 t30 -176.51 122.85 0.16 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.356 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.82 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -149.89 91.03 1.74 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.816 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -75.32 28.52 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.139 0.495 . . . . 0.0 109.841 178.723 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.889 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 2.0 ttm -114.14 163.28 15.42 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.77 -179.628 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.777 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.2 OUTLIER -56.9 137.78 54.74 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.897 179.849 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.644 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 2.1 mp0 -41.76 -78.9 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.924 -179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 16' ' ' GLU . 2.8 mm-40 -40.02 -27.29 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.779 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.842 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -75.4 -42.44 53.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.849 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.883 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -64.85 -32.86 74.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.894 179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.564 HE21 ' NH2' ' A' ' 4' ' ' ARG . 91.2 mt-30 -76.28 -42.04 46.79 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.157 0.503 . . . . 0.0 109.717 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.49 -30.73 67.6 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.58 -0.737 . . . . 0.0 109.669 179.058 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.823 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 21.9 t -66.84 -45.1 79.28 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.119 179.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.883 HG23 ' O ' ' A' ' 18' ' ' GLN . 46.8 t -59.98 -46.74 93.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.261 179.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -55.31 -40.74 71.47 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.071 179.246 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.786 ' HA ' ' HG3' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -66.23 -38.45 87.95 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.079 179.361 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.724 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -68.61 -26.93 65.61 Favored 'General case' 0 CA--C 1.512 -0.507 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 178.435 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.547 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 1.3 m -73.84 -40.23 63.46 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.795 178.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.786 ' HG3' ' HA ' ' A' ' 24' ' ' CYS . 7.0 mt-30 -56.87 -44.34 82.12 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.75 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.853 ' CB ' HG23 ' A' ' 38' ' ' ILE . . . -79.45 -21.83 44.97 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.544 179.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 1.093 HD21 HG11 ' A' ' 81' ' ' VAL . 6.5 mt -73.25 -44.09 60.04 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.084 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.411 ' HG3' ' N ' ' A' ' 31' ' ' LYS . 0.4 OUTLIER -81.48 -29.64 33.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.075 -179.712 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.493 ' CB ' ' CE1' ' A' ' 32' ' ' TYR . 2.4 mttm -77.77 -36.13 50.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.862 0.363 . . . . 0.0 110.757 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.627 ' CD1' ' N ' ' A' ' 32' ' ' TYR . 0.0 OUTLIER -150.33 151.8 33.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.815 179.693 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 1.043 ' HA ' HD11 ' A' ' 38' ' ' ILE . 1.6 m-80 -125.88 35.44 4.7 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.074 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.978 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 36.2 mm -98.44 32.09 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.099 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.756 ' N ' HD12 ' A' ' 38' ' ' ILE . 4.1 mp0 41.24 -86.76 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.376 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.615 ' N ' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.75 -50.98 5.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.307 179.26 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.978 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.9 OUTLIER -53.99 -54.24 41.76 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.323 179.368 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 1.043 HD11 ' HA ' ' A' ' 33' ' ' ASN . 4.7 mt -54.33 -59.08 2.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.829 179.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 1.015 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -48.74 -40.38 28.42 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.779 179.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -54.66 -67.59 0.25 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.81 179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.624 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -49.05 -45.72 43.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.76 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.796 HD11 HG22 ' A' ' 38' ' ' ILE . 58.7 mt -49.96 -48.8 22.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.969 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.651 ' HE2' ' HB3' ' A' ' 47' ' ' ASP . 8.4 tmtt? -66.81 -59.64 3.37 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.097 -179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.472 ' O ' ' OD1' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -40.04 -57.58 1.62 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.958 0.409 . . . . 0.0 110.971 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.697 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 1.6 tp10 -60.93 -38.25 85.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.263 -179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.823 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -69.19 -27.23 65.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.085 -179.651 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.816 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -90.3 -13.95 34.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.079 0.466 . . . . 0.0 110.414 179.677 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.609 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -111.39 -8.8 14.28 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.611 179.959 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.725 ' HD2' ' CE1' ' A' ' 50' ' ' TYR . 0.0 OUTLIER -106.56 -23.1 12.57 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.216 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.725 ' CE1' ' HD2' ' A' ' 49' ' ' LYS . 3.9 m-85 -123.94 -62.52 1.28 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.518 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.483 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 1.3 t30 156.19 121.98 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.154 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.973 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.816 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 31.4 Cg_endo -63.03 172.26 5.17 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 122.646 2.231 . . . . 0.0 112.686 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.553 ' HA ' ' CB ' ' A' ' 52' ' ' PRO . 36.0 m -102.08 133.72 46.47 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 122.819 0.448 . . . . 0.0 110.492 -0.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.767 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 56.0 m95 -104.23 140.23 38.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.286 0.565 . . . . 0.0 112.147 -179.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.862 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 0.6 OUTLIER -130.43 99.83 5.14 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.212 -0.903 . . . . 0.0 108.811 178.767 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 1.063 ' HB2' HD12 ' A' ' 85' ' ' LEU . 0.5 OUTLIER -116.89 167.81 10.79 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 112.944 0.72 . . . . 0.0 112.944 -177.648 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.958 HD13 ' O ' ' A' ' 56' ' ' CYS . 17.5 mm -135.14 156.49 39.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.789 178.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.015 HG12 ' HB2' ' A' ' 39' ' ' ALA . 10.0 p -158.9 109.34 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 120.935 0.397 . . . . 0.0 111.629 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.855 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -139.44 -130.76 2.75 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.85 -0.69 . . . . 0.0 112.019 179.711 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.628 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -164.04 -28.9 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.517 0 CA-C-O 120.737 0.303 . . . . 0.0 111.416 -179.678 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.45 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 53.0 t30 -152.88 45.98 0.69 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.964 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 1.009 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -103.0 -163.26 0.98 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.973 -179.965 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.817 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -147.43 90.84 0.15 Allowed Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.073 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.96 ' HA ' HG12 ' B' ' 57' ' ' ILE . 3.3 p -78.28 147.05 34.47 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.956 0.407 . . . . 0.0 111.22 -179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.828 ' CE2' ' HA ' ' B' ' 40' ' ' ALA . 13.2 t80 -154.6 62.61 0.67 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.645 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.74 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 4.5 m -124.59 140.0 49.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.324 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.901 ' CG2' HG21 ' B' ' 53' ' ' THR . 15.2 t -86.16 149.91 24.78 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.706 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.429 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.2 OUTLIER -78.3 -157.26 0.11 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.908 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.937 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 0.1 OUTLIER -140.86 -51.0 0.45 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.903 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.764 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 1.1 t -141.01 -60.37 0.49 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.868 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.764 ' HG2' ' C ' ' A' ' 70' ' ' THR . 0.0 OUTLIER -157.03 -136.88 0.05 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.776 -179.933 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.853 ' HA ' ' HG3' ' A' ' 13' ' ' MET . 2.9 m-70 31.75 35.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.164 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.889 ' N ' ' HB2' ' A' ' 13' ' ' MET . 6.5 t80 -116.73 100.69 7.98 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.748 0.309 . . . . 0.0 110.735 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.815 HD11 HD11 ' A' ' 8' ' ' ILE . 2.4 tt -117.19 153.17 18.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.969 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.6 ' N ' ' O ' ' A' ' 10' ' ' ASN . 10.0 t80 -149.83 93.23 2.0 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.66 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.904 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.3 OUTLIER -113.78 -176.17 2.84 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.33 -179.51 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.623 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 31.1 t80 -143.0 91.03 2.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.811 179.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.075 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.4 OUTLIER -49.4 174.42 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.927 -179.945 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.461 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.19 -59.95 0.26 Allowed Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.842 -0.694 . . . . 0.0 112.577 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.427 ' HB3' HE21 ' A' ' 80' ' ' GLN . 0.0 OUTLIER -133.57 34.05 3.48 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.753 0.311 . . . . 0.0 110.729 179.927 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 1.093 HG11 HD21 ' A' ' 29' ' ' LEU . 96.2 t -148.97 164.22 4.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.458 . . . . 0.0 111.272 -179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.992 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -129.95 153.18 48.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.59 179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.992 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.1 OUTLIER -144.5 118.49 3.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.884 0.373 . . . . 0.0 111.039 -179.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.868 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 6.5 tp -107.48 86.55 2.32 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.923 -179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 1.063 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -87.75 138.69 31.25 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.466 -179.868 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.719 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 1.4 p90 -175.5 125.81 0.24 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.321 179.578 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.767 ' HD2' ' CE2' ' A' ' 54' ' ' TRP . 53.1 mtpt -82.12 -171.7 3.55 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.797 179.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.937 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 2.2 m -139.6 19.87 2.53 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.305 0.574 . . . . 0.0 110.353 179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.347 -1.252 . . . . 0.0 112.469 -179.884 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.492 ' HB3' ' H ' ' B' ' 2' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.849 0.356 . . . . 0.0 111.207 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.686 ' O ' ' HB2' ' B' ' 3' ' ' ASP . 0.4 OUTLIER -167.47 -160.64 0.37 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.864 179.958 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.686 ' HB2' ' O ' ' B' ' 2' ' ' CYS . 17.4 m-20 79.61 103.49 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.966 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.493 ' HB2' ' H ' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 54.39 -98.56 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.973 179.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.666 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.2 OUTLIER 59.78 108.71 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.744 -179.848 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.051 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 161.21 -168.34 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.633 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.78 HG12 ' HE2' ' B' ' 9' ' ' LYS . 10.5 t -157.03 73.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.901 179.802 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.853 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.1 mp -38.16 150.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.833 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.78 ' HE2' HG12 ' B' ' 7' ' ' VAL . 63.2 mmtt -146.9 -3.3 0.59 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.217 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.485 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.0 OUTLIER 179.02 83.74 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.147 -179.924 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.861 ' HB1' ' NE2' ' B' ' 18' ' ' GLN . . . -109.63 72.86 0.82 Allowed 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.794 -179.151 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.766 ' HB2' ' HD2' ' B' ' 73' ' ' PHE . 0.6 OUTLIER -73.52 33.83 0.08 Allowed 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.752 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.954 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -129.56 172.05 11.97 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.296 -0.866 . . . . 0.0 110.716 -178.782 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.872 ' N ' ' HG2' ' B' ' 13' ' ' MET . 0.5 OUTLIER -51.98 133.21 32.83 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.94 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.787 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 3.2 mp0 -51.64 -69.43 0.11 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.408 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -52.21 -29.83 24.43 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.045 0.45 . . . . 0.0 110.517 -179.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.825 ' HG2' ' CG ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -75.17 -32.79 61.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.968 179.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.861 ' NE2' ' HB1' ' B' ' 11' ' ' ALA . 0.0 OUTLIER -76.06 -28.59 57.69 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.854 0.359 . . . . 0.0 110.352 179.271 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.487 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 5.2 mm100 -72.87 -40.29 65.76 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 109.187 -0.672 . . . . 0.0 109.187 178.84 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.545 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 8.7 m-20 -68.33 -30.59 69.6 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.403 -0.817 . . . . 0.0 109.17 178.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.814 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.8 OUTLIER -62.97 -48.7 77.73 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.498 -0.774 . . . . 0.0 109.976 178.97 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.954 HG22 ' CD2' ' B' ' 76' ' ' PHE . 95.5 t -55.25 -51.86 51.3 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.006 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.487 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 7.9 mt-10 -54.77 -36.34 64.75 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.862 179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -71.72 -36.18 70.41 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.834 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.657 ' HB2' HG21 ' B' ' 83' ' ' ILE . . . -70.65 -23.14 62.46 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 178.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.524 ' HA ' HD12 ' B' ' 29' ' ' LEU . 6.5 m -78.59 -42.2 29.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.169 -1.378 . . . . 0.0 109.599 178.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.78 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -54.04 -46.54 71.91 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.59 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.891 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -69.73 -36.77 76.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.005 178.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.655 HD11 ' HG ' ' B' ' 78' ' ' LEU . 5.8 mt -58.27 -53.0 63.24 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.026 179.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.11 -30.93 70.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.608 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.78 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 11.0 mmmt -75.99 -25.68 56.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.3 179.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.513 ' CG ' ' C ' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -171.92 133.51 0.73 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.868 179.898 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -92.76 26.58 2.66 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.043 0.449 . . . . 0.0 110.601 179.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.662 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 42.8 mm -96.39 103.57 14.83 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.688 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 1.032 ' HG3' ' HA2' ' B' ' 59' ' ' GLY . 0.2 OUTLIER -30.05 -70.46 0.05 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.976 -179.762 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.556 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -48.15 -53.77 15.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.902 0.382 . . . . 0.0 110.806 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.662 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 18.3 t0 -48.77 -62.17 1.65 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.63 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.969 ' HB ' HG11 ' B' ' 58' ' ' VAL . 16.6 mt -44.12 -50.78 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.047 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.81 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -54.58 -47.54 73.17 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.984 179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.828 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -60.01 -50.83 72.2 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.626 179.633 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.803 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.0 OUTLIER -52.9 -50.63 63.54 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.718 179.692 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.689 HD11 HG22 ' B' ' 38' ' ' ILE . 19.2 mt -59.97 -70.5 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.641 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.733 ' HD2' ' CE2' ' A' ' 65' ' ' TYR . 0.6 OUTLIER -38.54 -33.93 0.12 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.825 0.345 . . . . 0.0 110.93 -179.697 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.431 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 18.2 tttp -68.92 -60.45 2.36 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.034 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.764 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 3.0 mm-40 -62.29 -24.8 67.51 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.881 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.814 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -76.73 -38.81 53.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.605 179.759 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.608 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.6 OUTLIER -66.11 -35.59 80.91 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.714 179.791 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.505 ' HE2' ' HB3' ' B' ' 48' ' ' LYS . 3.0 mmmm -88.6 -32.51 18.06 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.247 -179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.764 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -76.35 -25.44 54.69 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.894 179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.702 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 26.0 m-85 -130.45 -68.47 0.69 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.942 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.702 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 1.4 t30 155.02 119.2 0.0 OUTLIER Pre-proline 0 C--O 1.232 0.147 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.188 -179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.619 ' CB ' ' HA ' ' B' ' 53' ' ' THR . 20.7 Cg_endo -60.4 175.73 1.03 Allowed 'Trans proline' 0 CA--C 1.532 0.39 0 C-N-CA 122.326 2.018 . . . . 0.0 112.346 -179.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.901 HG21 ' CG2' ' A' ' 67' ' ' THR . 2.0 m -100.51 131.44 46.43 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 122.951 0.5 . . . . 0.0 110.547 0.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.818 ' CZ3' ' HB3' ' B' ' 72' ' ' HIS . 64.6 m95 -103.14 100.86 10.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.007 -179.336 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.74 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . 20.5 m170 -73.45 94.37 2.08 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.982 ' HB2' HD12 ' B' ' 85' ' ' LEU . 0.5 OUTLIER -111.22 154.28 24.65 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.276 0.56 . . . . 0.0 112.148 -177.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.96 HG12 ' HA ' ' A' ' 64' ' ' SER . 29.9 mt -151.15 110.84 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.71 179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 0.969 HG11 ' HB ' ' B' ' 38' ' ' ILE . 1.4 p -107.03 131.61 56.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.187 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 1.032 ' HA2' ' HG3' ' B' ' 35' ' ' GLU . . . -149.46 -134.06 2.28 Favored Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.938 -0.649 . . . . 0.0 111.842 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.429 ' O ' ' HB2' ' B' ' 61' ' ' ASN . 1.5 ptm180 -161.51 1.66 0.06 Allowed 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 120.704 0.288 . . . . 0.0 111.105 -179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.488 ' O ' ' CD ' ' A' ' 35' ' ' GLU . 1.2 t-20 174.55 34.07 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.162 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 1.009 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 54.8 p90 -90.48 174.48 7.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.948 0.404 . . . . 0.0 110.76 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.626 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -123.02 74.17 0.39 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.035 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.889 ' HA ' HG23 ' A' ' 57' ' ' ILE . 28.4 p -74.35 102.76 4.5 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.879 0.371 . . . . 0.0 111.087 -179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.818 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 12.7 t80 -109.47 67.36 0.65 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.939 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.983 HG21 ' CE1' ' B' ' 86' ' ' PHE . 18.6 m -101.14 165.65 2.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.026 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.786 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 2.3 m -115.15 95.52 5.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.973 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.631 ' C ' ' HG2' ' B' ' 69' ' ' GLU . 0.0 OUTLIER -54.17 175.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.885 -179.907 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.677 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.4 OUTLIER -168.76 80.02 0.14 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.977 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.65 HG23 ' H ' ' B' ' 71' ' ' LYS . 0.1 OUTLIER 163.62 -97.24 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.901 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.726 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -175.72 16.86 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.552 179.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.954 ' HA ' ' HB2' ' B' ' 13' ' ' MET . 93.5 m-70 -126.93 69.47 1.27 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.195 -179.701 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.864 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.0 t80 -128.83 75.33 1.63 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.507 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.827 ' HA ' ' HA ' ' B' ' 11' ' ' ALA . 1.2 tt -91.23 129.38 42.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.376 -179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.682 ' CD1' ' HB2' ' B' ' 84' ' ' LEU . 17.1 t80 -128.29 87.45 2.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.489 179.657 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.954 ' CD2' HG22 ' B' ' 22' ' ' VAL . 4.8 p90 -109.7 164.27 12.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.24 -179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.711 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 53.8 t80 -123.38 114.79 20.63 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.71 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.051 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.3 OUTLIER -69.57 166.14 19.61 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.823 -179.788 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.483 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -30.81 -36.97 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.245 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.66 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.497 ' N ' ' O ' ' B' ' 78' ' ' LEU . 0.0 OUTLIER -151.33 30.73 0.61 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.914 0.388 . . . . 0.0 110.777 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.755 ' HB ' ' HB2' ' B' ' 78' ' ' LEU . 42.5 t -146.0 168.84 6.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.915 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.711 ' HB2' ' HD2' ' B' ' 77' ' ' TYR . . . -137.34 109.22 7.12 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.322 179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.73 HD13 HG23 ' B' ' 58' ' ' VAL . 0.9 OUTLIER -101.25 133.78 43.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 121.239 0.542 . . . . 0.0 112.068 -178.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.733 ' O ' HD12 ' B' ' 85' ' ' LEU . 0.1 OUTLIER -119.28 132.27 55.88 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.873 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.982 HD12 ' HB2' ' B' ' 56' ' ' CYS . 3.2 mp -137.35 101.5 4.54 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.099 0.476 . . . . 0.0 111.371 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.983 ' CE1' HG21 ' B' ' 66' ' ' VAL . 12.5 p90 -139.61 123.87 17.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.97 179.522 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.805 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -91.8 159.18 15.94 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.936 -179.931 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.677 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 1.3 m -117.64 19.95 13.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.31 0.576 . . . . 0.0 110.246 179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.55 -179.891 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 120.917 0.389 . . . . 0.0 111.104 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -173.37 140.87 0.86 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.774 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.799 ' H ' HH21 ' A' ' 4' ' ' ARG . 47.3 m-20 -116.98 -129.94 0.3 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.865 -179.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.799 HH21 ' H ' ' A' ' 3' ' ' ASP . 0.0 OUTLIER 70.99 -94.23 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.748 -179.968 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.565 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.6 OUTLIER 49.68 45.03 24.76 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.166 179.706 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.025 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -139.09 170.43 15.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.077 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.456 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 26.3 t -131.15 85.81 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.043 179.995 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.853 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -49.32 156.54 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 121.193 0.521 . . . . 0.0 110.826 -179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.74 ' HD3' ' O ' ' A' ' 8' ' ' ILE . 1.2 mmtp -144.78 -14.93 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.595 -0.73 . . . . 0.0 109.935 179.581 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -167.77 77.97 0.16 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.396 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.867 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -101.78 76.33 1.63 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.673 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.497 ' OD2' ' CD2' ' A' ' 68' ' ' HIS . 59.3 t0 -77.93 30.25 0.17 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.132 0.491 . . . . 0.0 109.973 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.922 ' SD ' ' HB3' ' A' ' 17' ' ' MET . 0.4 OUTLIER -121.91 163.34 19.43 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.86 -179.481 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.841 ' N ' ' HG2' ' A' ' 13' ' ' MET . 0.3 OUTLIER -50.13 128.43 19.07 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.976 179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.771 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 1.3 mm-40 -37.83 -75.61 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.022 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.797 ' O ' ' HG2' ' A' ' 19' ' ' GLN . 0.9 OUTLIER -44.33 -31.1 0.94 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 179.91 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.922 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -70.94 -37.01 72.85 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.249 179.535 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.867 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -68.54 -30.29 69.04 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.475 179.559 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.797 ' HG2' ' O ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -76.77 -38.3 54.34 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 179.44 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -71.4 -25.75 62.47 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.655 178.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.844 ' OG ' HG21 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -72.96 -50.66 22.03 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.106 179.196 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.855 HG23 ' O ' ' A' ' 18' ' ' GLN . 17.2 t -60.15 -38.27 76.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.528 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.716 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 47.5 mt-10 -67.15 -38.66 85.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.979 -0.555 . . . . 0.0 109.897 179.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 67.5 m -70.18 -34.77 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.606 178.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.845 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -72.52 -36.38 68.31 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.706 ' HA ' HD12 ' A' ' 29' ' ' LEU . 52.0 m -69.05 -36.5 77.75 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.54 -1.209 . . . . 0.0 109.565 178.447 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 11.9 mm100 -61.5 -39.35 90.65 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.479 178.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.973 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -71.92 -28.75 63.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.604 178.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.845 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.2 mt -72.7 -41.39 65.33 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.434 -0.803 . . . . 0.0 110.788 179.73 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -71.81 -32.75 67.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.152 -179.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.45 ' HB3' ' CE2' ' A' ' 32' ' ' TYR . 1.2 mtpp -86.71 -26.59 24.17 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.043 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.603 ' HE1' ' ND1' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -156.18 178.18 10.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.746 -179.865 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 1.062 ' HA ' HD11 ' A' ' 38' ' ' ILE . 0.4 OUTLIER -158.39 40.19 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.02 179.943 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.006 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 42.0 mm -103.61 39.28 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.984 179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.652 ' HB3' ' C ' ' B' ' 62' ' ' PHE . 4.5 mp0 43.33 -86.86 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.444 -0.344 . . . . 0.0 110.252 -179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.606 ' N ' ' O ' ' A' ' 34' ' ' ILE . 2.9 mtpt -48.82 -33.36 10.33 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.874 0.369 . . . . 0.0 110.228 179.154 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 1.006 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -65.88 -45.66 81.21 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.264 179.472 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 1.062 HD11 ' HA ' ' A' ' 33' ' ' ASN . 2.8 mp -65.1 -38.4 82.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.473 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.941 ' HB1' ' HB2' ' B' ' 65' ' ' TYR . . . -61.53 -43.13 99.43 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.424 179.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.739 ' HB2' ' CE1' ' B' ' 65' ' ' TYR . . . -62.38 -55.76 24.82 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.284 179.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.935 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.7 OUTLIER -47.81 -47.08 31.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.461 179.328 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.822 HG12 ' HA ' ' A' ' 25' ' ' ALA . 14.1 mt -67.18 -69.25 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.138 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.636 ' HG3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -43.42 -35.27 1.53 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.056 -179.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.511 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.3 OUTLIER -66.21 -62.19 1.62 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.04 0.448 . . . . 0.0 110.821 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.641 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 13.5 mt-10 -52.98 -51.24 62.21 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.87 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.815 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 1.4 m-85 -53.12 -52.14 59.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.898 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.79 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.8 OUTLIER -57.43 -27.03 62.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.027 -179.876 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.1 mmmt -113.94 9.61 17.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.147 -179.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.641 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -121.73 -5.12 9.17 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.111 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.613 ' CD1' ' HA ' ' A' ' 46' ' ' PHE . 11.5 m-85 -148.56 -61.69 0.24 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.307 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.538 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 1.2 p-10 161.45 117.08 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.445 -179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.79 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 33.2 Cg_endo -64.23 167.21 15.0 Favored 'Trans proline' 0 CA--C 1.532 0.377 0 C-N-CA 122.449 2.099 . . . . 0.0 112.568 -179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.884 HG21 HG21 ' B' ' 67' ' ' THR . 4.9 t -109.54 122.28 47.07 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.757 0.423 . . . . 0.0 110.773 -0.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.703 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 28.4 m95 -89.7 135.86 33.37 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.841 -179.304 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.831 ' CE1' HG22 ' B' ' 67' ' ' THR . 0.0 OUTLIER -102.21 104.84 15.43 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 108.763 -0.829 . . . . 0.0 108.763 178.161 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.594 ' HB3' HD12 ' A' ' 85' ' ' LEU . 1.6 m -113.11 125.14 54.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.121 0.486 . . . . 0.0 112.171 -178.148 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.736 HG12 ' HA ' ' B' ' 64' ' ' SER . 13.4 mt -126.42 99.73 5.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.781 179.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.841 HG11 ' HB ' ' A' ' 38' ' ' ILE . 3.3 p -99.63 123.54 52.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.996 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.771 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -146.0 -150.69 5.25 Favored Glycine 0 N--CA 1.447 -0.605 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.171 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.751 ' HG3' HH11 ' A' ' 60' ' ' ARG . 0.0 OUTLIER -158.28 13.5 0.19 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-O 120.935 0.398 . . . . 0.0 110.975 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.676 ' O ' ' HG2' ' B' ' 35' ' ' GLU . 35.1 t30 174.08 35.3 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.449 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.933 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 4.3 p90 -100.06 157.78 16.31 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.152 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.91 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -114.73 83.75 0.34 Allowed Glycine 0 N--CA 1.449 -0.442 0 N-CA-C 111.541 -0.624 . . . . 0.0 111.541 179.589 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.858 ' CB ' HD12 ' B' ' 57' ' ' ILE . 84.5 p -79.78 137.94 37.13 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.1 0.476 . . . . 0.0 111.75 -178.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.911 ' HB2' ' HB1' ' B' ' 39' ' ' ALA . 1.5 t80 -141.35 58.09 1.52 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.263 179.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.791 HG21 ' CE1' ' A' ' 86' ' ' PHE . 27.5 m -104.94 129.63 57.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.039 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.504 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 5.2 m -81.7 123.76 29.01 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.908 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.497 ' CD2' ' OD2' ' A' ' 12' ' ' ASP . 0.0 OUTLIER -71.79 172.92 8.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.613 179.743 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.537 ' O ' ' HB ' ' A' ' 70' ' ' THR . 7.3 pt-20 -169.74 75.09 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.066 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.776 ' O ' ' HG3' ' A' ' 71' ' ' LYS . 1.5 t 165.58 -104.62 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.077 179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.776 ' HG3' ' O ' ' A' ' 70' ' ' THR . 17.3 mtmt -171.91 18.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.814 -179.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.744 ' HA ' ' HB2' ' A' ' 13' ' ' MET . 66.5 m-70 -130.56 67.47 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.707 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.689 ' HA ' ' O ' ' A' ' 85' ' ' LEU . 1.8 t80 -133.16 93.42 3.17 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.597 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.844 HG21 ' OG ' ' A' ' 21' ' ' SER . 3.2 tt -108.96 122.69 64.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.323 -179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.759 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 34.9 t80 -116.11 88.51 2.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.453 179.721 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.853 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -113.3 168.85 9.39 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.934 0.397 . . . . 0.0 111.411 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.692 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 10.0 t80 -130.09 100.51 5.45 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.725 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.025 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.1 mm? -53.95 172.15 0.09 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.058 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -36.09 -36.57 0.14 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.689 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.522 ' O ' HG23 ' A' ' 81' ' ' VAL . 6.7 tp60 -151.5 41.23 0.7 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.872 0.368 . . . . 0.0 110.915 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.656 HG13 ' O ' ' A' ' 59' ' ' GLY . 42.1 t -158.6 166.54 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.014 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.692 ' HA ' ' HA ' ' A' ' 77' ' ' TYR . . . -134.33 110.12 9.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.602 HD13 HG23 ' A' ' 58' ' ' VAL . 0.3 OUTLIER -99.71 118.1 45.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-O 121.038 0.447 . . . . 0.0 111.597 -179.28 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.759 ' HB2' ' CE1' ' A' ' 75' ' ' TYR . 1.6 tp -102.74 90.68 3.89 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.111 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.689 ' O ' ' HA ' ' A' ' 73' ' ' PHE . 0.6 OUTLIER -99.23 124.62 44.44 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.478 -179.2 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.791 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.3 p90 -168.57 132.72 1.55 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.209 179.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.683 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -92.94 168.2 11.31 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.847 179.895 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.633 ' CB ' ' HE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -104.85 19.74 20.0 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.168 0.509 . . . . 0.0 110.826 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.393 -1.226 . . . . 0.0 112.481 -179.953 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.746 ' HA ' ' CE ' ' B' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.916 0.389 . . . . 0.0 111.219 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.475 ' C ' ' O ' ' B' ' 1' ' ' MET . 1.9 t -32.1 105.77 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.817 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.45 ' O ' ' N ' ' B' ' 5' ' ' LYS . 2.1 p30 -141.89 76.64 1.55 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.977 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.497 ' H ' ' HG2' ' B' ' 4' ' ' ARG . 0.3 OUTLIER -39.43 -28.14 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.505 179.779 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.675 ' HE3' ' H ' ' B' ' 6' ' ' ALA . 0.0 OUTLIER 57.42 -168.04 0.12 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.34 179.87 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.122 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 57.94 -178.34 0.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.514 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.757 ' O ' ' HD2' ' B' ' 9' ' ' LYS . 80.3 t -147.78 75.14 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.776 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.887 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -44.28 153.66 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.008 0.432 . . . . 0.0 110.211 179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.767 ' HD2' ' HA ' ' B' ' 76' ' ' PHE . 0.0 OUTLIER -135.29 -22.92 1.51 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.76 -0.654 . . . . 0.0 110.242 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.598 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 2.2 t-20 -145.74 -104.66 0.1 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.998 179.478 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.756 ' CB ' ' HA ' ' B' ' 74' ' ' ILE . . . 76.19 129.64 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.08 0.467 . . . . 0.0 112.091 178.828 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.711 ' H ' ' HD1' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -124.49 35.22 4.85 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.169 179.094 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.695 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 23.0 ttp -121.28 158.2 28.68 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.962 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.707 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -38.87 158.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.661 179.747 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.69 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 13.1 mt-10 -67.17 -57.39 6.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.854 0.359 . . . . 0.0 111.011 -179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.532 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.1 OUTLIER -55.75 -24.82 37.56 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.658 179.967 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.695 ' HB2' ' HG2' ' B' ' 13' ' ' MET . 0.0 OUTLIER -78.35 -43.53 27.48 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.856 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -60.75 -37.79 82.99 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.923 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.406 ' HG2' ' NE ' ' B' ' 4' ' ' ARG . 0.4 OUTLIER -74.74 -42.21 58.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.181 0.515 . . . . 0.0 109.907 179.502 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.64 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -65.19 -31.87 73.27 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.904 179.1 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.911 ' HB2' HD22 ' B' ' 85' ' ' LEU . 1.0 OUTLIER -66.01 -49.4 67.89 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.978 179.172 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.992 HG22 ' CD2' ' B' ' 76' ' ' PHE . 92.5 t -53.28 -46.52 57.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.672 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.534 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 5.0 mm-40 -61.94 -35.81 79.53 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.416 179.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.513 ' HB3' HG23 ' B' ' 42' ' ' ILE . 0.8 OUTLIER -70.48 -32.43 69.95 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.005 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.88 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.99 -40.59 68.45 Favored 'General case' 0 CA--C 1.511 -0.547 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 178.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.659 ' HA ' HD12 ' B' ' 29' ' ' LEU . 85.2 m -64.94 -42.51 94.58 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.876 178.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.534 ' HG3' ' O ' ' B' ' 23' ' ' GLU . 23.5 mt-30 -55.1 -46.84 75.54 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.853 179.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.885 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -63.45 -32.62 74.11 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.529 -0.76 . . . . 0.0 110.38 179.155 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.88 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.0 OUTLIER -68.51 -51.39 43.62 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.186 -179.778 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.65 -33.25 71.3 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.969 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.421 ' HB3' ' CE1' ' B' ' 32' ' ' TYR . 13.1 mttt -82.88 -35.09 26.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.77 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.487 ' HE2' ' HB2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -146.64 150.87 36.29 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.737 179.839 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.661 ' C ' HD13 ' B' ' 34' ' ' ILE . 0.1 OUTLIER -114.97 32.05 6.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.007 -179.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.967 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.1 mm -114.93 110.97 33.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.82 179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.91 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 3.4 mp0 -29.99 -70.79 0.05 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.24 -179.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.912 ' HE3' HG22 ' B' ' 34' ' ' ILE . 0.0 OUTLIER -46.23 -48.25 17.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.738 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.967 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.0 OUTLIER -56.9 -62.16 1.94 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.631 179.762 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.885 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 4.2 mt -45.82 -45.39 4.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.885 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 1.069 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -59.35 -55.33 36.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.713 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.794 ' HA ' ' CE2' ' A' ' 65' ' ' TYR . . . -51.02 -45.07 61.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.667 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.845 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.5 t60 -59.1 -50.95 72.09 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.766 179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.787 HG12 ' HA ' ' B' ' 25' ' ' ALA . 26.0 mt -60.71 -70.34 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.288 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.653 ' HD2' ' O ' ' B' ' 54' ' ' TRP . 1.5 ttpt -37.19 -57.14 0.89 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.999 -179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.54 -44.67 73.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.087 -179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.2 OUTLIER -63.8 -33.72 76.3 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.759 -179.935 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.761 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -74.67 -36.38 62.81 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.702 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.79 ' OD2' ' HB3' ' B' ' 52' ' ' PRO . 0.2 OUTLIER -68.82 -35.71 77.31 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.822 -0.627 . . . . 0.0 110.953 -179.976 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.461 ' HE3' ' HB3' ' B' ' 48' ' ' LYS . 17.6 mmmt -90.75 -38.76 12.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.774 -179.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.569 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 1.0 OUTLIER -77.79 -22.42 50.16 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.887 -178.942 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.77 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 77.7 m-85 -120.61 -71.16 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.898 0.332 . . . . 0.0 111.898 -179.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.77 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.5 t-20 158.54 118.68 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.155 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 -179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.79 ' HB3' ' OD2' ' B' ' 47' ' ' ASP . 10.6 Cg_endo -53.3 167.21 0.86 Allowed 'Trans proline' 0 CA--C 1.534 0.484 0 C-N-CA 122.438 2.092 . . . . 0.0 112.791 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.64 HG22 ' NE2' ' B' ' 55' ' ' HIS . 16.3 m -104.68 131.37 52.19 Favored 'General case' 0 C--N 1.344 0.335 0 C-N-CA 122.774 0.43 . . . . 0.0 110.55 0.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.764 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 60.4 m95 -105.81 139.36 40.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.358 0.599 . . . . 0.0 111.884 -179.181 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.827 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.1 98.76 4.84 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.133 -0.939 . . . . 0.0 108.642 178.662 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.777 ' HA ' ' O ' ' B' ' 84' ' ' LEU . 0.4 OUTLIER -119.87 162.03 19.83 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.453 0.644 . . . . 0.0 112.485 -177.795 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.881 ' HB ' ' HB3' ' B' ' 84' ' ' LEU . 20.0 mm -127.94 162.31 34.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.43 179.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.069 HG12 ' HB2' ' B' ' 39' ' ' ALA . 4.9 p -160.24 102.35 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.833 0.349 . . . . 0.0 111.331 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.833 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -136.73 -123.72 2.27 Favored Glycine 0 N--CA 1.449 -0.474 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.102 179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -174.61 -46.15 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 120.787 0.327 . . . . 0.0 111.2 -179.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 21.5 m-20 -132.25 52.99 2.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.235 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.933 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -113.84 -154.08 0.54 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.909 0.385 . . . . 0.0 110.642 179.792 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.713 ' O ' ' HA ' ' A' ' 57' ' ' ILE . . . -154.53 103.84 0.24 Allowed Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 121.058 -0.592 . . . . 0.0 111.676 179.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.736 ' HA ' HG12 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -96.2 137.9 34.6 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.121 0.486 . . . . 0.0 111.486 -179.205 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.941 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 0.2 OUTLIER -143.83 51.71 1.32 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.157 179.6 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.698 HG12 ' HB3' ' A' ' 55' ' ' HIS . 4.5 m -99.6 139.9 20.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.729 -0.668 . . . . 0.0 111.44 -179.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.884 HG21 HG21 ' A' ' 53' ' ' THR . 2.3 t -76.69 138.4 39.99 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.852 179.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.483 ' CD2' ' CB ' ' B' ' 12' ' ' ASP . 13.9 p-80 -110.81 159.04 18.02 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.059 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -158.58 176.71 12.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.657 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.651 ' C ' ' HG2' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 66.42 -92.82 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.976 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.651 ' HG2' ' C ' ' B' ' 70' ' ' THR . 0.9 OUTLIER 164.97 43.46 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.934 -179.882 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.564 ' CG ' ' HD3' ' B' ' 87' ' ' LYS . 89.3 m-70 -134.32 46.86 2.45 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.717 179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.711 ' HD1' ' H ' ' B' ' 12' ' ' ASP . 1.0 OUTLIER -126.94 139.93 52.7 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.525 -179.96 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.856 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.5 OUTLIER -149.64 129.32 3.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.956 0.408 . . . . 0.0 111.595 179.819 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.732 ' HD1' HD12 ' B' ' 84' ' ' LEU . 8.5 t80 -114.2 133.54 55.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.925 -0.58 . . . . 0.0 109.986 179.146 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.992 ' CD2' HG22 ' B' ' 22' ' ' VAL . 0.2 OUTLIER -165.23 170.02 15.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.344 -179.506 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.693 ' OH ' ' HA ' ' B' ' 80' ' ' GLN . 5.8 t80 -132.67 116.7 16.96 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.042 179.761 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.122 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 3.7 mm? -69.91 167.04 18.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.827 179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.553 ' O ' ' HG2' ' B' ' 80' ' ' GLN . . . -28.3 -37.23 0.01 OUTLIER Glycine 0 CA--C 1.519 0.296 0 C-N-CA 121.084 -0.579 . . . . 0.0 112.949 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.693 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 5.3 mt-30 -154.42 38.8 0.44 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.727 0.299 . . . . 0.0 111.08 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.833 HG13 ' O ' ' B' ' 59' ' ' GLY . 53.2 t -158.32 167.9 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.111 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.98 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -124.36 160.45 28.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.662 179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.98 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.0 OUTLIER -147.5 131.6 9.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 121.038 0.447 . . . . 0.0 111.409 -179.583 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.881 ' HB3' ' HB ' ' B' ' 57' ' ' ILE . 4.0 tp -122.73 90.92 3.39 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.307 179.633 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.911 HD22 ' HB2' ' B' ' 21' ' ' SER . 0.9 OUTLIER -92.89 140.92 28.99 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.051 0.453 . . . . 0.0 111.682 -179.216 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.73 ' HZ ' ' HZ ' ' A' ' 86' ' ' PHE . 1.4 p90 -177.09 131.86 0.18 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.749 179.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.764 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.8 OUTLIER -96.73 158.65 15.33 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.56 179.519 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.827 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.6 OUTLIER -103.17 19.22 19.99 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.235 0.54 . . . . 0.0 110.511 179.799 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.424 -179.986 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.858 0.361 . . . . 0.0 111.115 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.453 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.0 p -149.63 115.52 5.65 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.929 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.437 ' O ' ' HB2' ' A' ' 4' ' ' ARG . 3.1 t70 -98.47 -38.01 9.36 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.968 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.437 ' HB2' ' O ' ' A' ' 3' ' ' ASP . 4.7 mtp180 64.83 35.3 8.66 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.526 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.729 ' O ' HD13 ' A' ' 78' ' ' LEU . 15.3 tppt? -37.69 122.49 0.96 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.936 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.028 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 156.21 156.95 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.719 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.49 ' C ' ' H ' ' A' ' 77' ' ' TYR . 58.0 t -123.38 78.85 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.006 179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.866 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.1 mp -48.85 164.92 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.171 0.51 . . . . 0.0 110.636 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.743 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -163.16 -13.47 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.975 179.733 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.572 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -164.52 89.12 0.51 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.32 179.863 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.901 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -126.03 93.43 3.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.715 -179.32 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 73' ' ' PHE . 9.1 t70 -85.15 28.98 0.68 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.906 179.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.758 ' HB2' ' N ' ' A' ' 73' ' ' PHE . 34.6 ttp -120.28 157.67 28.66 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.983 -179.432 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.79 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 2.3 m -41.32 147.36 0.16 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.556 179.734 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.47 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.9 OUTLIER -54.89 -56.29 21.11 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.248 -179.69 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.9 ' HA ' ' HG2' ' A' ' 19' ' ' GLN . 0.2 OUTLIER -62.29 -27.59 69.14 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.944 0.402 . . . . 0.0 110.251 179.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.76 ' HA ' ' OD2' ' A' ' 20' ' ' ASP . 39.7 mmm -71.29 -30.82 66.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.498 179.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.956 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -79.25 -29.03 42.43 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.212 179.327 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.9 ' HG2' ' HA ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -77.53 -43.95 30.29 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.652 179.165 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.76 ' OD2' ' HA ' ' A' ' 17' ' ' MET . 4.9 p30 -70.86 -31.05 67.62 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.492 178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.771 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.3 t -65.14 -46.26 81.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.041 179.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.821 HG22 ' CD2' ' A' ' 76' ' ' PHE . 53.0 t -59.51 -46.87 92.54 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.088 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.705 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 28.7 mt-10 -56.46 -34.25 66.68 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.053 -0.521 . . . . 0.0 109.863 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.624 ' SG ' ' HA ' ' A' ' 42' ' ' ILE . 49.8 t -71.46 -36.53 71.24 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.076 179.064 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.765 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -71.78 -30.78 65.91 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.65 ' HA ' HD12 ' A' ' 29' ' ' LEU . 27.8 m -71.92 -37.99 69.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 114.252 -1.34 . . . . 0.0 109.429 178.547 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.817 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -59.69 -44.41 93.65 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.547 -0.751 . . . . 0.0 109.608 179.042 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.979 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -71.91 -25.61 61.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.6 -0.727 . . . . 0.0 109.838 179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.711 HD12 ' O ' ' A' ' 25' ' ' ALA . 3.0 mt -72.82 -45.73 56.89 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.148 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -77.83 -21.88 50.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.106 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.817 ' HG2' ' O ' ' A' ' 27' ' ' GLN . 23.9 mmtt -90.04 -26.47 20.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.084 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.453 ' CE1' ' HA ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -166.98 115.22 0.83 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.949 -179.844 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.47 ' OD1' ' O ' ' A' ' 29' ' ' LEU . 28.9 m-20 -81.54 32.79 0.35 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.087 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.816 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 39.7 mm -102.62 101.68 12.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.101 179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.515 ' C ' ' O ' ' A' ' 34' ' ' ILE . 1.8 mp0 -24.15 -86.96 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.221 -179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.408 ' H ' ' HG3' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -40.03 -37.11 0.55 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.754 179.839 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.816 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.4 OUTLIER -63.15 -62.19 1.87 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.645 179.811 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.979 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 20.8 mt -47.34 -44.22 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.661 179.6 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 1.038 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -58.22 -46.98 84.89 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.483 179.503 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.802 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -57.97 -61.09 2.79 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.325 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.843 ' CG ' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -40.98 -58.6 1.68 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.607 179.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.991 HG21 HD11 ' A' ' 85' ' ' LEU . 6.1 mt -52.22 -70.94 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.507 -179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.747 ' HD2' ' C ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -38.17 -54.84 1.35 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.031 -179.777 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.31 -62.74 1.28 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.042 0.448 . . . . 0.0 110.963 -179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.76 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -52.11 -50.7 61.14 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.152 -179.93 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.771 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 1.5 m-85 -57.81 -35.67 71.17 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.159 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.777 ' HA ' ' HD1' ' A' ' 54' ' ' TRP . 0.4 OUTLIER -74.13 -21.16 59.98 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.876 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HD2' ' HA ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -122.39 13.38 10.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.331 -179.728 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.76 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -129.37 6.35 5.28 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.39 -179.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.537 ' CD2' ' CD1' ' A' ' 46' ' ' PHE . 97.2 m-85 -148.61 -65.65 0.24 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.791 0.329 . . . . 0.0 111.225 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.453 ' CB ' ' O ' ' A' ' 50' ' ' TYR . 2.6 t-20 163.34 102.83 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.613 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.733 ' HA ' ' OD1' ' A' ' 47' ' ' ASP . 45.8 Cg_exo -36.87 154.49 0.03 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.665 2.243 . . . . 0.0 112.711 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.814 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 25.9 m -114.44 140.86 48.36 Favored 'General case' 0 C--N 1.345 0.37 0 C-N-CA 123.047 0.539 . . . . 0.0 110.369 -0.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.777 ' HD1' ' HA ' ' A' ' 47' ' ' ASP . 76.9 m95 -105.62 145.09 31.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.527 0.68 . . . . 0.0 112.422 -178.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.919 ' NE2' ' HB2' ' A' ' 88' ' ' SER . 4.5 m-70 -136.18 101.66 4.76 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 114.836 -1.075 . . . . 0.0 108.819 179.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.838 ' SG ' HD12 ' A' ' 85' ' ' LEU . 0.0 OUTLIER -119.76 165.74 14.15 Favored 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -177.796 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.036 HG13 HD23 ' A' ' 84' ' ' LEU . 17.8 mm -133.86 169.66 21.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 114.956 -1.02 . . . . 0.0 110.22 179.056 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.038 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.0 p -166.13 117.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.78 0.324 . . . . 0.0 111.475 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.624 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -151.08 -154.41 6.52 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.919 -0.658 . . . . 0.0 112.06 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.754 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -157.54 32.62 0.27 Allowed 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.759 0.314 . . . . 0.0 111.388 -179.757 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.754 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 0.2 OUTLIER 163.94 29.38 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.74 179.851 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.833 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.0 OUTLIER -106.6 172.89 6.57 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.312 -179.772 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.831 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -126.2 94.51 0.43 Allowed Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 111.608 -0.597 . . . . 0.0 111.608 179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.921 ' HB2' HD22 ' A' ' 84' ' ' LEU . 69.6 p -82.01 123.61 29.06 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.078 0.466 . . . . 0.0 111.693 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.927 ' H ' HD13 ' B' ' 57' ' ' ILE . 5.0 t80 -135.11 64.08 1.6 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.16 179.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.939 HG13 HD11 ' B' ' 57' ' ' ILE . 26.7 m -101.75 148.11 7.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.145 -179.613 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.774 HG21 HG21 ' B' ' 53' ' ' THR . 5.4 m -91.14 76.05 6.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.62 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.509 ' CG ' ' CD2' ' A' ' 73' ' ' PHE . 50.8 p-80 -55.1 169.69 0.23 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.087 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.463 ' C ' ' OG1' ' A' ' 70' ' ' THR . 0.5 OUTLIER -151.73 169.4 22.29 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.864 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.463 ' OG1' ' C ' ' A' ' 69' ' ' GLU . 0.3 OUTLIER 78.18 -101.77 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.052 179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.673 ' O ' ' HA ' ' A' ' 13' ' ' MET . 0.0 OUTLIER 179.03 28.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.826 -179.866 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 1.092 ' HB2' ' HG3' ' A' ' 87' ' ' LYS . 32.6 m-70 -126.95 52.78 1.75 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.919 -179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.886 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 2.9 t80 -126.29 114.99 19.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.157 179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.956 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.3 tt -126.4 137.24 58.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.895 0.379 . . . . 0.0 111.555 -179.598 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.572 ' N ' ' O ' ' A' ' 10' ' ' ASN . 38.4 t80 -126.65 116.39 20.93 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.213 179.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.866 ' HA ' ' HA ' ' A' ' 8' ' ' ILE . 2.5 p90 -139.02 163.29 32.78 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.004 0.431 . . . . 0.0 111.456 -179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.627 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 25.8 t80 -121.17 93.41 4.01 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.499 179.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.028 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 2.3 mm? -43.78 172.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.645 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.488 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -30.82 -39.61 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.584 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.544 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -153.52 21.55 0.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.956 0.408 . . . . 0.0 110.767 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.79 HG12 ' H ' ' A' ' 82' ' ' ALA . 28.5 t -134.91 177.77 6.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.898 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.996 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -137.95 153.33 49.47 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.805 0.336 . . . . 0.0 110.857 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.996 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.4 OUTLIER -143.49 120.91 6.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.254 -179.665 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.036 HD23 HG13 ' A' ' 57' ' ' ILE . 13.2 tp -104.6 90.51 3.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.482 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.991 HD11 HG21 ' A' ' 42' ' ' ILE . 0.3 OUTLIER -95.47 141.92 28.44 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.648 -179.465 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.886 ' HB3' ' HD1' ' A' ' 73' ' ' PHE . 47.0 p90 177.48 138.74 0.07 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.698 179.335 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 1.092 ' HG3' ' HB2' ' A' ' 72' ' ' HIS . 8.0 mtmt -97.44 174.11 6.84 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.66 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.919 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.2 OUTLIER -126.99 16.84 7.31 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.309 0.576 . . . . 0.0 110.534 179.45 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 CA-C-O 118.364 -1.242 . . . . 0.0 112.558 179.945 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 75.2 mmm . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 120.784 0.326 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.685 ' O ' HG21 ' B' ' 26' ' ' THR . 0.0 OUTLIER -154.47 -88.49 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.993 -179.99 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.411 ' H ' ' HB3' ' B' ' 2' ' ' CYS . 0.4 OUTLIER -58.61 145.53 39.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.834 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.641 HH11 ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER 62.75 -97.44 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.72 -179.929 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.584 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 49.61 30.46 3.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.07 179.93 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.041 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -124.99 -166.89 1.59 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.145 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.526 ' N ' ' O ' ' B' ' 77' ' ' TYR . 57.8 t -151.18 73.84 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.957 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.955 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.0 OUTLIER -41.04 159.15 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 121.093 0.473 . . . . 0.0 110.826 -179.775 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.761 ' HG2' ' C ' ' B' ' 8' ' ' ILE . 0.2 OUTLIER -155.04 -10.57 0.12 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.511 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.573 ' O ' ' N ' ' B' ' 75' ' ' TYR . 0.0 OUTLIER -164.6 84.79 0.42 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.34 -179.966 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.821 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . -123.53 88.99 3.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.881 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.611 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 10.8 t0 -87.6 25.35 1.48 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.26 0.552 . . . . 0.0 109.959 179.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.896 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.1 OUTLIER -110.96 166.84 10.71 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.656 -179.723 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.893 ' N ' ' HG2' ' B' ' 13' ' ' MET . 23.2 t -50.07 120.34 4.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.769 0.319 . . . . 0.0 110.731 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.877 ' HA ' ' HG3' ' B' ' 18' ' ' GLN . 3.2 mp0 -32.95 -67.55 0.12 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.178 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.459 ' H ' ' HG2' ' B' ' 16' ' ' GLU . 0.9 OUTLIER -46.93 -44.99 20.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.674 179.902 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.896 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 31.7 mmm -61.23 -32.08 71.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.787 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.93 ' CA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -68.35 -43.16 78.08 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.878 179.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.488 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 2.9 mp0 -69.36 -33.87 73.74 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.406 -0.59 . . . . 0.0 109.406 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -71.4 -33.26 69.32 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.966 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.813 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.6 OUTLIER -67.94 -40.74 83.23 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.22 179.435 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.812 ' HA ' ' CE2' ' B' ' 76' ' ' PHE . 10.7 t -62.97 -46.12 97.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.376 179.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.593 ' HG2' ' H ' ' B' ' 4' ' ' ARG . 29.8 mt-10 -62.58 -32.33 73.29 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.894 179.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.43 ' SG ' ' HD1' ' B' ' 46' ' ' PHE . 4.9 t -73.45 -36.44 65.9 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.908 179.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.956 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -69.27 -36.54 77.21 Favored 'General case' 0 CA--C 1.51 -0.586 0 N-CA-C 108.045 -1.094 . . . . 0.0 108.045 178.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.685 HG21 ' O ' ' B' ' 2' ' ' CYS . 87.5 m -64.76 -42.79 94.88 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.618 178.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.631 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 12.8 mm100 -52.63 -48.67 66.22 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.803 179.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.812 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -59.83 -43.83 94.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.377 -0.828 . . . . 0.0 110.359 179.282 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.956 HD12 ' O ' ' B' ' 25' ' ' ALA . 0.9 OUTLIER -59.56 -60.57 3.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.806 179.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -48.57 -33.74 10.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.995 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.631 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 0.0 OUTLIER -85.28 -27.73 25.78 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.39 -179.692 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.571 ' HE2' ' CB ' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -155.12 150.82 27.56 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.831 0.348 . . . . 0.0 111.226 -179.202 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.518 ' O ' HD13 ' B' ' 34' ' ' ILE . 35.6 t30 -115.36 47.07 1.36 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.95 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.887 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 42.0 mm -126.08 108.56 19.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.864 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.831 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 26.7 mp0 -29.53 -70.85 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.133 -179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.23 -49.11 61.72 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.766 0.317 . . . . 0.0 110.741 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.887 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 1.8 t0 -53.22 -64.27 0.87 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.862 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.842 HG21 ' HG ' ' B' ' 29' ' ' LEU . 11.6 mt -48.9 -43.74 14.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.691 179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.98 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.32 -46.71 76.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.468 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.809 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -61.42 -67.27 0.42 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.496 179.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.797 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.7 OUTLIER -34.15 -40.96 0.1 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.538 179.44 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.868 HG21 HD11 ' B' ' 85' ' ' LEU . 33.9 mt -67.33 -50.91 58.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.298 -179.742 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.712 ' HG3' ' O ' ' B' ' 54' ' ' TRP . 6.1 tttt -55.33 -46.88 76.33 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.174 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -67.24 -36.83 82.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.209 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.596 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 8.5 mm-40 -68.45 -44.8 74.11 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.905 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.813 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.5 OUTLIER -67.37 -35.27 79.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.678 179.95 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.833 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -66.79 -38.77 87.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.221 179.763 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.994 ' HA ' ' HE3' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.66 -18.21 25.5 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.111 179.974 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.649 ' HZ2' ' HB3' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -88.75 -29.58 19.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.383 -179.573 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.624 ' HE2' ' CD1' ' B' ' 46' ' ' PHE . 7.0 m-85 -131.74 -57.16 0.99 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.533 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.606 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 27.4 t-20 157.23 119.36 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.11 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.418 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.833 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 20.3 Cg_endo -59.77 170.72 3.31 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 122.558 2.172 . . . . 0.0 112.255 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.774 HG21 HG21 ' A' ' 67' ' ' THR . 4.4 m -106.85 129.47 54.69 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 123.154 0.582 . . . . 0.0 110.475 0.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.714 ' CD2' ' HD2' ' B' ' 87' ' ' LYS . 58.0 m95 -101.74 116.81 33.54 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.83 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 0.0 OUTLIER -93.69 100.14 12.43 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 178.286 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.74 ' O ' HD13 ' B' ' 57' ' ' ILE . 0.0 OUTLIER -108.54 148.62 30.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.305 0.574 . . . . 0.0 112.457 -178.005 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.978 ' CG1' HD23 ' B' ' 84' ' ' LEU . 19.5 mm -133.6 103.7 5.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 115.203 -0.908 . . . . 0.0 110.376 179.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 0.98 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.4 p -105.87 117.78 52.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.398 -179.477 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.852 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -132.43 -104.88 0.94 Allowed Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.177 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.572 ' HD3' ' CG ' ' A' ' 61' ' ' ASN . 1.0 OUTLIER 179.67 -17.71 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.458 0 CA-C-O 120.777 0.323 . . . . 0.0 111.131 -179.778 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.469 ' CG ' ' O ' ' B' ' 60' ' ' ARG . 1.2 m120 177.78 41.31 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.142 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.833 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 27.6 p90 -87.61 -167.71 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.867 0.365 . . . . 0.0 110.89 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -131.41 86.6 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.898 -0.667 . . . . 0.0 112.19 179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.954 ' HA ' HG23 ' A' ' 57' ' ' ILE . 5.5 p -83.3 119.01 24.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.935 0.398 . . . . 0.0 111.315 -179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.802 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 22.9 t80 -127.28 73.35 1.43 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.367 179.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.761 HG21 ' CE1' ' B' ' 86' ' ' PHE . 21.1 m -125.15 156.47 34.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.404 -179.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.76 ' HB ' ' CE1' ' A' ' 55' ' ' HIS . 20.7 m -84.99 145.99 27.43 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.756 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.743 ' HB2' ' HA ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -97.5 173.44 7.17 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.925 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.722 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 1.3 mm-40 -138.59 -114.92 0.15 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.12 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.582 ' C ' ' H ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -47.29 -103.45 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.066 -179.78 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.669 ' O ' ' HB2' ' B' ' 72' ' ' HIS . 1.3 mmtt -55.45 0.23 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.951 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.769 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 0.7 OUTLIER 76.77 -89.5 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.622 -179.859 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.769 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 3.8 p90 163.46 155.85 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.986 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.93 HD12 ' CA ' ' B' ' 18' ' ' GLN . 1.1 tt -129.6 130.65 67.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.204 179.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.688 ' CE1' ' HB2' ' B' ' 84' ' ' LEU . 2.6 t80 -113.57 132.32 55.77 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.056 179.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.955 ' HA ' ' HA ' ' B' ' 8' ' ' ILE . 0.4 OUTLIER -158.21 152.54 24.4 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.966 0.412 . . . . 0.0 111.373 -179.45 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.582 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 1.0 OUTLIER -119.74 112.02 18.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.759 179.7 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.041 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -71.11 170.61 12.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.598 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.507 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.19 -55.93 0.06 OUTLIER Glycine 0 C--N 1.332 0.342 0 C-N-CA 121.063 -0.589 . . . . 0.0 112.94 -179.775 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -139.54 35.89 2.03 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.797 0.332 . . . . 0.0 111.035 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.852 HG13 ' O ' ' B' ' 59' ' ' GLY . 92.2 t -151.05 170.19 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.21 179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 1.014 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -130.18 157.73 41.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.652 179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 1.014 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -146.18 133.3 14.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.906 0.384 . . . . 0.0 111.537 -179.608 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.978 HD23 ' CG1' ' B' ' 57' ' ' ILE . 0.5 OUTLIER -126.87 90.59 3.18 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.004 179.481 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.868 HD11 HG21 ' B' ' 42' ' ' ILE . 0.3 OUTLIER -90.74 130.74 36.7 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.809 -178.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.761 ' CE1' HG21 ' B' ' 66' ' ' VAL . 1.6 p90 -169.15 120.97 0.75 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.833 179.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.745 ' HB3' ' O ' ' B' ' 53' ' ' THR . 0.0 OUTLIER -87.67 162.99 16.79 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.909 -179.9 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.83 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 3.0 m -115.87 19.25 15.25 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.184 0.516 . . . . 0.0 110.89 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.425 -1.208 . . . . 0.0 112.581 179.951 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.518 ' HA ' HH12 ' A' ' 4' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.3 0 CA-C-O 120.851 0.357 . . . . 0.0 111.204 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 172.98 -35.81 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.758 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -130.51 -1.53 4.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.603 179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.787 ' HB2' HH11 ' A' ' 4' ' ' ARG . 0.0 OUTLIER -63.09 -47.3 83.46 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.953 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 6.8 tttp 43.89 -162.98 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.121 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.065 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 59.41 175.78 0.08 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.34 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.741 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 3.8 t -144.59 73.05 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.546 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.993 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -43.24 130.2 1.1 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.181 0 CA-C-O 120.883 0.373 . . . . 0.0 110.104 179.578 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.781 ' HE3' ' HB3' ' A' ' 77' ' ' TYR . 2.4 mmtp -120.91 -12.56 8.77 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.631 -179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.645 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 2.6 t30 -149.78 -92.1 0.07 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.383 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.883 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . 67.21 -163.79 0.22 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.772 179.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.606 ' N ' ' O ' ' A' ' 73' ' ' PHE . 3.5 t0 169.34 31.38 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.967 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.891 ' SD ' ' HB ' ' A' ' 74' ' ' ILE . 0.0 OUTLIER -106.07 160.34 15.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.146 -179.439 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.573 ' O ' ' N ' ' A' ' 16' ' ' GLU . 0.9 OUTLIER -65.78 72.26 0.06 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.781 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.709 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 3.4 mt-10 32.92 -88.57 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.213 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.573 ' N ' ' O ' ' A' ' 14' ' ' SER . 6.3 pt-20 -31.36 -32.72 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.108 -179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.741 ' HG3' ' CB ' ' A' ' 13' ' ' MET . 6.4 tpp -75.02 -45.53 41.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.054 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.759 ' CA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -63.22 -29.28 70.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 0.0 110.831 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.643 ' OE1' ' HG3' ' A' ' 4' ' ' ARG . 74.1 mm-40 -76.92 -45.07 29.22 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 179.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.76 ' HB3' ' OH ' ' A' ' 50' ' ' TYR . 0.4 OUTLIER -68.68 -30.9 69.68 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.803 178.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.817 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 0.9 OUTLIER -64.55 -48.16 76.09 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.678 178.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.8 HG22 ' CD2' ' A' ' 76' ' ' PHE . 55.7 t -55.56 -50.48 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.183 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -52.88 -37.96 61.11 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.382 179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.673 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 76.5 m -68.93 -36.85 78.46 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.147 0.499 . . . . 0.0 110.185 179.266 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.747 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -69.66 -30.06 67.65 Favored 'General case' 0 CA--C 1.512 -0.498 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 178.427 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.771 ' HA ' HD12 ' A' ' 29' ' ' LEU . 94.8 m -74.08 -43.29 58.22 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-N 114.182 -1.372 . . . . 0.0 110.103 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.827 ' HG3' ' N ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -52.66 -44.16 66.0 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 179.075 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 1.004 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -75.47 -26.58 58.35 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.205 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.921 HD11 ' HG ' ' A' ' 78' ' ' LEU . 3.6 mt -67.72 -44.93 76.45 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.672 -0.694 . . . . 0.0 111.374 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -81.0 -28.98 35.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.053 -179.689 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.562 ' HB3' ' CE1' ' A' ' 32' ' ' TYR . 0.6 OUTLIER -77.43 -31.04 53.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.972 0.415 . . . . 0.0 110.92 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.642 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -160.82 138.86 9.66 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.511 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.638 ' HA ' HD11 ' A' ' 38' ' ' ILE . 2.6 m120 -100.97 27.84 5.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.043 0.449 . . . . 0.0 110.627 179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.77 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 50.4 mm -99.63 91.62 2.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.966 179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.744 ' HG2' ' HA2' ' A' ' 59' ' ' GLY . 4.1 mp0 -23.25 -78.93 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.144 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.69 ' HD2' ' CG2' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.42 -42.3 3.19 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.899 179.725 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.77 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.3 t0 -63.61 -60.73 2.96 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.993 0.425 . . . . 0.0 110.583 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 1.004 HG23 ' HB3' ' A' ' 28' ' ' ALA . 41.0 mt -47.97 -40.23 8.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.409 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.999 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -69.31 -41.78 76.29 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.39 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.75 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -54.39 -57.46 11.2 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.225 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.623 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -59.17 -57.32 13.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.98 -179.874 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.747 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 91.8 mt -38.67 -45.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.337 -179.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.729 ' HD3' ' O ' ' A' ' 54' ' ' TRP . 0.0 OUTLIER -68.3 -59.61 3.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.019 -179.77 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.445 ' O ' ' OD2' ' A' ' 47' ' ' ASP . 0.1 OUTLIER -43.76 -51.23 7.4 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.209 -0.451 . . . . 0.0 111.294 -179.656 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 5.0 tt0 -65.74 -49.31 68.88 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.991 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.817 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -58.21 -27.98 64.41 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.097 -179.947 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.744 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -81.01 -34.11 33.15 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.864 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.4 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -98.75 5.95 47.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.125 -179.946 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -126.44 -5.69 6.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.871 179.922 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.76 ' OH ' ' HB3' ' A' ' 20' ' ' ASP . 53.8 m-85 -136.82 -63.93 0.6 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.065 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.684 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 7.1 t-20 160.82 110.59 0.0 OUTLIER Pre-proline 0 C--N 1.33 -0.24 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.38 -179.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.744 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 35.1 Cg_exo -58.38 157.69 25.55 Favored 'Trans proline' 0 CA--C 1.533 0.468 0 C-N-CA 122.433 2.088 . . . . 0.0 112.478 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.918 HG21 HG21 ' B' ' 67' ' ' THR . 11.1 t -108.84 139.0 44.27 Favored 'General case' 0 C--N 1.344 0.329 0 C-N-CA 122.932 0.493 . . . . 0.0 110.49 -0.101 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.828 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 62.2 m95 -101.9 121.14 41.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.2 0.524 . . . . 0.0 112.193 -178.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.838 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.1 OUTLIER -103.36 93.71 5.11 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 178.436 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.917 ' O ' HD13 ' A' ' 57' ' ' ILE . 1.6 p -112.78 161.7 16.61 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.323 0.583 . . . . 0.0 112.489 -178.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.964 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 21.9 mm -134.15 159.01 42.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.036 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.999 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.3 p -157.59 107.7 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.881 0.372 . . . . 0.0 111.531 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.744 ' HA2' ' HG2' ' A' ' 35' ' ' GLU . . . -143.58 -153.67 5.93 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 121.018 -0.61 . . . . 0.0 112.207 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.697 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 0.0 OUTLIER -162.68 28.5 0.1 Allowed 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -179.628 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.697 ' HB2' ' O ' ' A' ' 60' ' ' ARG . 30.5 t30 167.94 27.09 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 120.907 -0.317 . . . . 0.0 111.458 179.787 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.973 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -98.54 -157.24 0.59 Allowed 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.978 179.721 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.584 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -154.85 81.17 0.17 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.879 -0.677 . . . . 0.0 112.118 -179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.799 ' HA ' HG12 ' B' ' 57' ' ' ILE . 74.0 p -66.69 161.2 23.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.012 0.435 . . . . 0.0 111.326 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.764 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 63.3 t80 -167.8 45.32 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.484 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.806 HG21 ' CE1' ' A' ' 86' ' ' PHE . 3.5 m -97.56 152.44 4.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.872 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 1.027 HG22 ' CE1' ' B' ' 55' ' ' HIS . 1.0 OUTLIER -96.96 147.96 23.46 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.995 -179.778 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.508 ' HB3' ' CD2' ' A' ' 73' ' ' PHE . 0.0 OUTLIER -97.74 169.81 9.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.687 179.847 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.646 ' O ' HG23 ' A' ' 70' ' ' THR . 2.6 pt-20 -170.31 69.98 0.06 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.345 -0.389 . . . . 0.0 111.106 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.646 HG23 ' O ' ' A' ' 69' ' ' GLU . 0.1 OUTLIER 167.24 -110.94 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.231 179.822 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.706 ' O ' ' HA ' ' A' ' 13' ' ' MET . 20.5 pttm -162.19 6.1 0.06 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.662 -179.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.845 ' HB2' ' HD3' ' A' ' 87' ' ' LYS . 2.1 m-70 -117.35 61.88 0.74 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.949 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.724 ' HD1' ' HB3' ' A' ' 86' ' ' PHE . 4.3 t80 -133.69 94.77 3.34 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.746 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.891 ' HB ' ' SD ' ' A' ' 13' ' ' MET . 2.4 tt -110.18 134.82 51.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.304 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.645 ' HB3' ' HB3' ' A' ' 10' ' ' ASN . 3.4 t80 -127.15 88.86 2.87 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.231 179.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.993 ' HB3' HG13 ' A' ' 8' ' ' ILE . 3.1 p90 -114.86 174.35 6.02 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.36 -179.309 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.781 ' HB3' ' HE3' ' A' ' 9' ' ' LYS . 24.2 t80 -130.61 105.23 7.69 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.749 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.065 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.3 mm? -55.05 163.99 0.94 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.912 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.478 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -31.27 -47.38 0.18 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.782 -0.723 . . . . 0.0 112.484 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -139.54 20.09 2.54 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.869 0.366 . . . . 0.0 110.709 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.782 HG12 ' H ' ' A' ' 82' ' ' ALA . 28.3 t -139.19 177.4 4.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.705 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.984 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -138.24 151.15 47.38 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.43 -0.35 . . . . 0.0 110.55 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.984 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.3 OUTLIER -141.89 122.04 11.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 120.957 0.408 . . . . 0.0 111.039 -179.696 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.964 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 4.7 tp -109.82 85.05 2.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.713 -179.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.676 ' HG ' ' HB3' ' A' ' 56' ' ' CYS . 0.2 OUTLIER -87.84 137.91 31.92 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.05 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.806 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.6 p90 -179.26 132.01 0.11 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.132 -0.486 . . . . 0.0 111.373 179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.845 ' HD3' ' HB2' ' A' ' 72' ' ' HIS . 1.2 mtpm? -102.49 -157.68 0.62 Allowed 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.781 179.734 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.79 ' HB2' ' CE1' ' A' ' 55' ' ' HIS . 0.3 OUTLIER -156.47 20.53 0.35 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.319 0.58 . . . . 0.0 110.569 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.129 0 CA-C-O 118.336 -1.258 . . . . 0.0 112.453 -179.962 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.408 ' HB3' ' H ' ' B' ' 2' ' ' CYS . 1.7 mtt . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.822 0.344 . . . . 0.0 111.149 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.411 ' O ' ' SG ' ' B' ' 2' ' ' CYS . 1.2 p -103.21 128.66 50.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.026 -179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -141.79 -166.02 2.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.877 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.502 ' H ' ' HG2' ' B' ' 4' ' ' ARG . 0.0 OUTLIER -101.54 -54.67 2.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.84 179.986 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.523 ' O ' ' HG3' ' B' ' 5' ' ' LYS . 0.0 OUTLIER 49.12 29.45 2.53 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.917 -179.911 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.073 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -123.78 -168.3 1.76 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.302 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.641 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 40.2 t -153.46 76.51 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.209 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.771 ' HA ' ' HA ' ' B' ' 76' ' ' PHE . 1.4 mp -35.04 146.43 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.002 0.429 . . . . 0.0 110.538 179.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.912 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 8.8 mmpt? -121.74 -23.39 5.54 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.376 179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.526 HD22 ' HZ ' ' B' ' 73' ' ' PHE . 5.2 t30 -153.11 -86.67 0.06 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.334 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.8 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 59.05 120.49 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.672 179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.653 ' HB2' ' CE1' ' B' ' 73' ' ' PHE . 0.5 OUTLIER -117.75 25.12 10.61 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.261 0.553 . . . . 0.0 110.263 179.268 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.836 ' H ' HE22 ' B' ' 18' ' ' GLN . 14.0 ttp -108.45 169.78 8.43 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.756 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.718 ' H ' ' HG3' ' B' ' 13' ' ' MET . 0.8 OUTLIER -52.51 132.88 35.7 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.798 179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.527 ' H ' ' HG3' ' B' ' 15' ' ' GLU . 0.0 OUTLIER -42.73 -65.96 0.42 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.902 179.983 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -43.86 -34.12 1.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.969 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.807 ' SD ' ' HD3' ' B' ' 71' ' ' LYS . 0.0 OUTLIER -73.49 -32.72 64.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.942 ' O ' HG23 ' B' ' 22' ' ' VAL . 0.9 OUTLIER -68.48 -37.58 80.27 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.354 -0.385 . . . . 0.0 110.89 179.988 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.643 ' O ' ' HG3' ' B' ' 23' ' ' GLU . 0.0 OUTLIER -73.62 -38.35 65.09 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 179.432 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.35 -35.07 71.04 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.657 -0.702 . . . . 0.0 109.759 179.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.822 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.3 OUTLIER -63.66 -40.82 97.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.746 -0.661 . . . . 0.0 109.844 179.131 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.942 HG23 ' O ' ' B' ' 18' ' ' GLN . 27.5 t -63.57 -44.6 98.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.304 179.312 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.643 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 51.5 mt-10 -57.59 -38.73 75.38 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.424 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.904 ' HB3' HG23 ' B' ' 42' ' ' ILE . 0.0 OUTLIER -67.82 -36.62 80.71 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.318 179.53 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.869 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.7 -30.08 65.28 Favored 'General case' 0 CA--C 1.512 -0.503 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 178.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.424 ' HA ' HD12 ' B' ' 29' ' ' LEU . 11.4 m -73.29 -39.24 65.5 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.619 178.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.846 ' HB3' ' NE2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -57.74 -43.7 85.56 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.404 178.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 1.008 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -68.8 -37.86 79.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.181 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.869 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -63.33 -39.5 94.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.779 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.16 -23.36 38.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.919 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.746 ' HD3' ' CE1' ' B' ' 41' ' ' HIS . 0.1 OUTLIER -86.8 -25.36 24.64 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.811 179.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.6 ' CE1' ' HB3' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -157.63 175.1 14.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.559 -179.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 25.0 p30 -133.62 38.4 3.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.081 -179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.918 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 5.0 mm -121.4 106.16 17.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.67 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.689 ' HB3' ' O ' ' B' ' 58' ' ' VAL . 3.2 mp0 -29.52 -70.5 0.05 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.937 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.443 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.0 OUTLIER -47.87 -37.84 14.91 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.622 179.603 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.918 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 20.0 t0 -66.92 -60.26 2.8 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.671 179.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 1.059 ' HB ' HG11 ' B' ' 58' ' ' VAL . 4.3 mt -47.71 -47.34 11.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.769 179.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.937 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -55.66 -50.37 70.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.636 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.764 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -56.44 -62.1 1.95 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.56 179.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.846 ' NE2' ' HB3' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -36.18 -55.02 0.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.234 179.436 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.904 HG23 ' HB3' ' B' ' 24' ' ' CYS . 16.3 mt -51.39 -69.98 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.089 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.827 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.0 OUTLIER -34.94 -63.34 0.32 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.909 -179.862 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.414 ' O ' ' OD2' ' B' ' 47' ' ' ASP . 0.3 OUTLIER -46.21 -41.63 13.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.114 -179.997 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.783 ' HB3' ' SG ' ' B' ' 24' ' ' CYS . 2.0 tp10 -69.36 -44.16 72.13 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.89 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.822 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 1.4 m-85 -65.9 -29.86 70.36 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.929 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.935 ' HB2' ' HB3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -72.63 -40.56 66.35 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.693 179.882 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.528 ' HA ' ' HE2' ' B' ' 48' ' ' LYS . 0.0 OUTLIER -90.12 -17.97 26.7 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.052 -179.793 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.742 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.6 OUTLIER -88.34 -36.42 16.64 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.763 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.689 ' O ' ' HB3' ' B' ' 51' ' ' ASN . 2.1 m-85 -123.46 -57.73 1.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.101 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.689 ' HB3' ' O ' ' B' ' 50' ' ' TYR . 5.9 p-10 154.3 119.62 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.105 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.747 -179.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.935 ' HB3' ' HB2' ' B' ' 47' ' ' ASP . 19.2 Cg_endo -59.09 168.49 4.56 Favored 'Trans proline' 0 CA--C 1.533 0.435 0 C-N-CA 122.254 1.969 . . . . 0.0 112.556 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.839 HG21 HG21 ' A' ' 67' ' ' THR . 1.2 t -112.7 119.16 37.13 Favored 'General case' 0 C--N 1.343 0.308 0 C-N-CA 122.726 0.41 . . . . 0.0 111.001 0.035 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.788 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 26.6 m95 -91.2 113.74 26.08 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.38 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 1.027 ' CE1' HG22 ' A' ' 67' ' ' THR . 3.2 m-70 -72.55 116.13 12.64 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.827 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 3.6 m -114.95 135.8 53.82 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.278 0.561 . . . . 0.0 112.438 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.799 HG12 ' HA ' ' A' ' 64' ' ' SER . 13.7 mt -139.98 104.92 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.322 -0.853 . . . . 0.0 110.02 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.059 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.8 p -112.52 125.81 69.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.684 -179.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.759 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -146.14 -131.33 2.25 Favored Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.682 179.538 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -165.69 -0.34 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 120.774 0.321 . . . . 0.0 111.091 -179.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -173.96 34.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.104 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.973 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 5.8 p90 -93.67 163.42 13.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.933 0.397 . . . . 0.0 110.675 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.726 ' CA ' ' HB3' ' A' ' 35' ' ' GLU . . . -118.15 80.27 0.31 Allowed Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.883 -0.675 . . . . 0.0 111.815 179.718 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.91 ' HA ' HD12 ' A' ' 57' ' ' ILE . 16.0 p -77.9 128.02 33.29 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.125 0.488 . . . . 0.0 111.368 -179.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.75 ' CG ' ' HA ' ' A' ' 40' ' ' ALA . 25.2 t80 -136.85 68.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.348 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.887 HG13 HD11 ' A' ' 57' ' ' ILE . 29.8 m -111.58 151.81 13.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.107 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.918 HG21 HG21 ' A' ' 53' ' ' THR . 3.7 t -80.97 120.12 24.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.885 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.713 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -60.0 157.27 13.09 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.933 -179.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.582 ' HG2' ' C ' ' B' ' 68' ' ' HIS . 2.3 mt-10 -148.77 151.85 35.54 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.97 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.782 HG22 ' N ' ' B' ' 71' ' ' LYS . 42.2 m 57.63 -107.64 0.38 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.556 -179.676 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.807 ' HD3' ' SD ' ' B' ' 17' ' ' MET . 26.7 mttp -72.2 8.29 1.37 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.01 0.433 . . . . 0.0 110.375 179.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.772 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 24.8 m-70 79.6 -86.78 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.431 -179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.772 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 160.91 -175.05 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.745 179.686 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.898 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -158.13 117.58 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.099 179.626 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.82 ' HD2' ' HB2' ' B' ' 9' ' ' LYS . 13.2 t80 -108.15 139.21 43.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.605 179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.807 ' CE2' ' HA ' ' B' ' 22' ' ' VAL . 1.3 p90 -160.32 169.98 22.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.608 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.636 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 23.5 t80 -132.02 113.83 13.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.738 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.073 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.4 mm? -70.93 169.43 14.82 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.781 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.51 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -25.51 -51.82 0.05 OUTLIER Glycine 0 C--N 1.333 0.372 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.845 -179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.468 ' O ' HG23 ' B' ' 81' ' ' VAL . 3.0 tt0 -143.25 41.61 1.5 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.81 0.338 . . . . 0.0 110.405 179.758 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.759 HG13 ' O ' ' B' ' 59' ' ' GLY . 60.4 t -157.9 169.9 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.189 -179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.653 ' N ' HG12 ' B' ' 81' ' ' VAL . . . -135.12 141.74 46.06 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.329 179.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.825 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.2 OUTLIER -128.79 130.53 68.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.085 0.469 . . . . 0.0 111.939 -179.416 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.679 HD23 ' HB ' ' B' ' 57' ' ' ILE . 0.4 OUTLIER -117.33 97.88 6.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.245 179.545 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.791 HD11 HG21 ' B' ' 42' ' ' ILE . 1.2 mp -101.09 112.43 24.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.403 -179.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.771 ' CE1' HG21 ' B' ' 66' ' ' VAL . 6.7 p90 -149.71 128.8 12.71 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.752 179.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.788 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 42.4 mtpt -93.4 170.12 9.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.296 -179.581 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.756 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.3 OUTLIER -119.2 19.27 12.9 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.638 179.728 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.459 -1.189 . . . . 0.0 112.544 -179.976 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.815 0.341 . . . . 0.0 111.227 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 3' ' ' ASP . 36.1 m -63.07 -14.69 51.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.03 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.796 ' HB3' ' NH2' ' A' ' 4' ' ' ARG . 14.3 m-20 71.37 98.77 0.07 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.881 179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.796 ' NH2' ' HB3' ' A' ' 3' ' ' ASP . 0.0 OUTLIER 80.67 88.84 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.929 -179.975 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.915 ' O ' HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -54.53 -170.53 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.859 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.101 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . 81.47 152.29 0.11 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.437 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.629 HG12 ' O ' ' A' ' 7' ' ' VAL . 55.5 t -113.89 74.65 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.809 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.857 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -39.01 158.38 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.741 -179.894 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.668 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.7 OUTLIER -151.69 -8.92 0.22 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.764 -179.932 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.538 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -172.95 92.17 0.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.41 180.0 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.825 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -128.76 77.04 1.76 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.786 -179.509 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.57 ' HB3' ' HB3' ' A' ' 72' ' ' HIS . 0.2 OUTLIER -73.72 26.94 0.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.186 0.517 . . . . 0.0 110.064 179.104 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.873 ' HG2' ' N ' ' A' ' 14' ' ' SER . 0.0 OUTLIER -111.84 171.24 7.62 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.564 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.873 ' N ' ' HG2' ' A' ' 13' ' ' MET . 18.9 m -56.47 151.56 13.11 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.767 179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.689 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -56.26 -65.31 0.63 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.956 -179.98 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.743 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.4 OUTLIER -51.39 -25.23 5.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.099 -179.9 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.768 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 68.1 mmm -78.77 -36.23 43.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.061 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 1.049 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -73.34 -36.81 66.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.761 179.885 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.733 ' CB ' ' HG2' ' A' ' 4' ' ' ARG . 37.0 mt-30 -74.74 -36.33 62.64 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.194 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.743 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -73.02 -31.72 64.65 Favored 'General case' 0 N--CA 1.452 -0.355 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.678 178.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.79 ' HA ' ' CZ ' ' A' ' 46' ' ' PHE . 0.0 OUTLIER -64.77 -46.18 83.22 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.835 179.142 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.915 HG11 ' O ' ' A' ' 5' ' ' LYS . 97.2 t -60.06 -50.66 79.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.405 179.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.702 ' HG3' ' O ' ' A' ' 19' ' ' GLN . 6.5 mt-10 -52.97 -37.94 61.68 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.364 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 56.9 m -65.19 -40.27 93.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.135 0.493 . . . . 0.0 110.056 179.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.799 ' C ' HD12 ' A' ' 29' ' ' LEU . . . -68.42 -33.39 74.14 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.276 -1.009 . . . . 0.0 108.276 178.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.728 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 0.2 OUTLIER -71.51 -35.97 70.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.483 -1.235 . . . . 0.0 109.748 178.773 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.575 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 1.6 mt-30 -57.4 -42.96 83.28 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.373 179.044 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.998 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -85.93 -24.16 26.68 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.332 179.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 1.032 HD13 ' HG ' ' A' ' 78' ' ' LEU . 4.7 mt -75.51 -26.35 58.04 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.728 179.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -95.47 -35.27 11.77 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.607 179.804 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.575 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -83.96 -8.59 59.12 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.321 179.541 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.633 ' CD2' ' HE1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -154.17 -174.57 5.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.791 179.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -154.57 26.2 0.45 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.569 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.083 ' HB ' ' HB3' ' A' ' 37' ' ' ASP . 11.5 mm -116.01 102.24 13.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.836 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.853 ' HB3' ' N ' ' B' ' 63' ' ' GLY . 4.5 mp0 -25.28 -78.53 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.183 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.793 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -41.56 -46.24 3.52 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.703 179.63 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 1.083 ' HB3' ' HB ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -58.03 -60.04 4.34 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.779 179.807 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.998 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 2.1 mt -48.61 -46.92 15.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.839 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 1.039 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -59.92 -53.14 61.32 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.04 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.691 ' HA ' ' CG ' ' B' ' 65' ' ' TYR . . . -42.16 -56.65 2.8 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.062 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.639 ' H ' ' CD2' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -59.69 -57.04 14.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.907 -179.974 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.752 ' CD1' ' HA ' ' A' ' 25' ' ' ALA . 56.5 mt -42.9 -68.13 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.14 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.746 ' HB3' ' CD2' ' B' ' 65' ' ' TYR . 1.5 tmtt? -50.9 -34.85 30.05 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.94 -179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.03 -68.94 0.26 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.861 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.593 ' O ' ' N ' ' A' ' 49' ' ' LYS . 39.8 mt-10 -48.23 -54.05 14.9 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.7 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.79 ' CZ ' ' HA ' ' A' ' 21' ' ' SER . 0.8 OUTLIER -45.9 -51.66 12.77 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.796 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.791 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -64.23 -23.35 67.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.172 -179.837 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.58 11.43 18.29 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.242 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.593 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -130.4 -8.62 4.18 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.743 179.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.665 ' HD1' ' HA ' ' A' ' 46' ' ' PHE . 84.0 m-85 -136.58 -63.5 0.62 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.85 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.558 ' O ' ' NE1' ' A' ' 54' ' ' TRP . 0.5 OUTLIER 157.25 117.98 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.212 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.258 -179.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.791 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 20.6 Cg_endo -60.86 167.08 9.23 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 122.422 2.081 . . . . 0.0 112.42 -179.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.779 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.0 OUTLIER -108.86 122.18 46.66 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.039 0.536 . . . . 0.0 110.803 0.046 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.816 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 36.5 m95 -93.48 149.92 20.85 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.159 0.504 . . . . 0.0 112.034 -179.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.757 ' HD1' ' HB ' ' B' ' 66' ' ' VAL . 5.4 m-70 -127.37 103.49 7.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.417 -0.81 . . . . 0.0 109.418 178.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.871 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.6 OUTLIER -112.45 132.41 55.07 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.351 0.5 . . . . 0.0 112.351 -178.503 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.025 HG21 HG21 ' B' ' 57' ' ' ILE . 29.1 mm -120.24 107.17 20.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.167 178.755 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.039 HG12 ' HB2' ' A' ' 39' ' ' ALA . 4.8 p -107.5 131.21 58.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.966 0.412 . . . . 0.0 111.609 -179.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.924 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.9 -142.79 3.52 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.817 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.441 ' HD3' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -160.21 3.58 0.08 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.743 0.272 . . . . 0.0 111.679 -179.856 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -177.4 31.71 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.156 -0.218 . . . . 0.0 111.422 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 1.071 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.1 OUTLIER -92.37 -160.28 0.73 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.964 0.412 . . . . 0.0 110.983 179.777 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.736 ' HA3' ' HB3' ' B' ' 35' ' ' GLU . . . -152.72 78.59 0.2 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 121.034 -0.603 . . . . 0.0 111.941 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 1.078 ' HB2' HD12 ' B' ' 57' ' ' ILE . 25.6 p -72.9 140.27 47.39 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 120.972 0.415 . . . . 0.0 111.142 -179.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.818 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 61.2 t80 -152.68 84.17 1.23 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.513 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.869 HG21 ' CE1' ' A' ' 86' ' ' PHE . 3.2 m -132.21 168.08 24.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.282 -179.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 1.01 HG21 HG21 ' B' ' 53' ' ' THR . 1.3 t -83.78 -178.48 7.02 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.616 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.748 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER -130.13 153.03 48.93 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.705 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.957 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 5.3 mm-40 -127.05 -124.61 0.23 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.272 -179.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.545 ' OG1' ' HE2' ' A' ' 87' ' ' LYS . 11.2 p -31.11 -99.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.779 -179.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.701 ' O ' ' HB2' ' A' ' 13' ' ' MET . 3.0 mmtp -73.18 27.61 0.06 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.093 -179.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.772 ' O ' ' HB3' ' A' ' 73' ' ' PHE . 21.1 m-70 62.05 -90.63 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.98 179.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.772 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 0.1 OUTLIER 161.66 158.24 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.503 -179.904 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 1.049 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.7 OUTLIER -127.77 134.7 64.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-O 121.023 0.44 . . . . 0.0 111.301 179.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.788 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 1.4 t80 -124.79 138.84 54.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.161 179.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.861 ' CD2' HG22 ' A' ' 22' ' ' VAL . 0.6 OUTLIER -163.65 164.45 23.98 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.876 0.37 . . . . 0.0 111.032 -179.692 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.981 ' HD1' ' HB2' ' A' ' 82' ' ' ALA . 74.6 t80 -127.49 94.52 4.0 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.081 -179.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.101 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 3.6 mm? -44.05 158.21 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.855 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.455 ' C ' ' O ' ' A' ' 78' ' ' LEU . . . -32.92 -28.91 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.639 -179.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.598 ' N ' ' O ' ' A' ' 78' ' ' LEU . 13.5 pt20 -153.13 33.41 0.47 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.918 0.39 . . . . 0.0 110.946 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.966 HG11 HD21 ' A' ' 29' ' ' LEU . 72.6 t -156.48 170.89 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.922 -179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.981 ' HB2' ' HD1' ' A' ' 77' ' ' TYR . . . -136.56 119.05 15.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.464 -0.335 . . . . 0.0 110.858 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.823 HD11 HD11 ' A' ' 29' ' ' LEU . 0.3 OUTLIER -111.6 129.33 67.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.003 0.43 . . . . 0.0 111.612 -179.644 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.012 HD22 ' HB2' ' A' ' 64' ' ' SER . 0.6 OUTLIER -116.22 92.0 3.76 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.279 179.647 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.871 HD12 ' HB3' ' A' ' 56' ' ' CYS . 3.1 mp -92.85 135.15 34.38 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.003 -179.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.869 ' CE1' HG21 ' A' ' 66' ' ' VAL . 1.4 p90 -171.65 121.14 0.49 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.058 179.664 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.816 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 1.8 ptmt -104.53 143.16 33.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.785 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.957 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -105.44 16.77 25.0 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.299 0.571 . . . . 0.0 110.814 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.442 -1.199 . . . . 0.0 112.31 179.845 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.884 0.374 . . . . 0.0 111.243 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.403 ' O ' ' HB3' ' B' ' 3' ' ' ASP . 62.9 m -103.29 -62.7 1.25 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.714 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.464 ' C ' ' OD1' ' B' ' 3' ' ' ASP . 28.4 p30 179.05 178.52 0.46 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.778 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.949 HH21 HD13 ' B' ' 8' ' ' ILE . 7.8 tpt180 60.89 6.71 1.26 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.004 0.431 . . . . 0.0 110.568 -179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.671 ' O ' HD13 ' B' ' 78' ' ' LEU . 13.3 tttt -30.62 111.62 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.935 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.98 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 160.74 -172.15 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.853 -179.938 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.779 ' O ' ' HE3' ' B' ' 9' ' ' LYS . 53.0 t -150.36 71.63 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.813 179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.961 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.6 OUTLIER -44.84 143.24 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.973 -179.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.779 ' HE3' ' O ' ' B' ' 7' ' ' VAL . 8.8 mmpt? -112.17 -28.41 7.97 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.923 179.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.618 ' O ' ' HB3' ' B' ' 11' ' ' ALA . 0.1 OUTLIER -157.5 -91.45 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.241 179.6 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.806 ' HA ' ' HA ' ' B' ' 74' ' ' ILE . . . 78.44 97.68 0.06 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.184 -0.462 . . . . 0.0 112.066 178.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' B' ' 73' ' ' PHE . 1.2 t0 -90.47 29.84 1.23 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.18 0.514 . . . . 0.0 109.975 178.805 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.921 ' SD ' ' HB3' ' B' ' 17' ' ' MET . 0.0 OUTLIER -116.25 153.26 32.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.606 -179.66 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.755 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -37.0 154.8 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.889 -179.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.569 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 0.0 OUTLIER -61.79 -68.22 0.34 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.794 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -48.3 -24.06 1.09 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.666 179.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.921 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 0.0 OUTLIER -76.88 -42.56 39.36 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.865 179.851 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 1.1 ' HB3' HG13 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -65.32 -29.15 69.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 121.035 0.445 . . . . 0.0 110.252 179.525 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.505 ' NE2' ' HD3' ' B' ' 4' ' ' ARG . 4.3 mm100 -77.59 -43.26 32.23 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.28 0.562 . . . . 0.0 109.598 179.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.617 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.9 OUTLIER -69.78 -27.69 65.13 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.411 -0.813 . . . . 0.0 109.682 178.895 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.804 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 2.5 t -68.04 -49.56 60.7 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.928 179.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.908 HG22 ' CD2' ' B' ' 76' ' ' PHE . 76.7 t -55.77 -46.54 79.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.156 179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -59.53 -40.26 86.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.023 179.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.626 ' HB2' ' HE1' ' B' ' 46' ' ' PHE . 1.3 m -66.68 -34.28 77.51 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.759 179.086 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.829 ' O ' HD12 ' B' ' 29' ' ' LEU . . . -71.45 -32.26 68.11 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 178.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.522 ' HA ' HD12 ' B' ' 29' ' ' LEU . 12.4 m -70.94 -41.25 71.4 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 114.142 -1.39 . . . . 0.0 109.858 178.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.797 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 3.3 mm100 -55.83 -46.9 78.02 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 115.809 -0.632 . . . . 0.0 109.752 179.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 1.002 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -65.58 -34.39 78.13 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.403 179.239 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.829 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -66.21 -50.18 64.72 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.16 -179.949 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . 0.683 ' HG3' ' O ' ' B' ' 27' ' ' GLN . 0.5 OUTLIER -66.7 -27.59 67.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.013 -179.811 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.797 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 28.0 mmtp -85.68 -26.81 25.74 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.89 179.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.573 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -157.33 151.78 25.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.729 -179.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.679 ' C ' HD13 ' B' ' 34' ' ' ILE . 1.5 p30 -113.28 36.37 3.58 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.903 -179.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.83 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.6 mm -118.98 108.72 24.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.811 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.932 ' HA ' HD12 ' B' ' 38' ' ' ILE . 54.7 mm-40 -29.7 -71.08 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.024 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.465 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 0.1 OUTLIER -46.32 -45.99 17.88 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.895 0.379 . . . . 0.0 110.646 179.694 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.83 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 15.0 t0 -58.92 -61.28 2.75 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.85 179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 1.002 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 2.1 mt -43.93 -47.75 2.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.816 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 1.042 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -57.14 -59.43 5.1 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.529 179.548 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.818 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -45.63 -61.57 1.65 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.329 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.779 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 0.9 OUTLIER -41.62 -49.04 4.15 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.264 179.387 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.666 ' CD1' ' HA ' ' B' ' 25' ' ' ALA . 18.8 mt -61.51 -68.64 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.895 179.719 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.815 ' HE2' ' HB3' ' B' ' 47' ' ' ASP . 1.4 tptm -39.62 -27.58 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.873 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.689 ' HA ' ' OD2' ' B' ' 47' ' ' ASP . 0.0 OUTLIER -75.98 -60.34 2.37 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.0 0.429 . . . . 0.0 110.858 179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.736 ' HG2' ' O ' ' B' ' 41' ' ' HIS . 0.4 OUTLIER -60.56 -25.88 66.5 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.04 179.991 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.804 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.4 OUTLIER -76.86 -48.04 19.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.419 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.815 ' HB3' ' HE2' ' B' ' 43' ' ' LYS . 3.2 p30 -64.21 -27.17 68.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.274 179.435 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.439 ' HG3' ' N ' ' B' ' 49' ' ' LYS . 0.0 OUTLIER -90.03 -41.61 11.61 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.029 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.68 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -79.04 -20.02 49.96 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.048 -179.632 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.685 ' CD1' ' HA ' ' B' ' 46' ' ' PHE . 8.9 m-85 -128.66 -70.03 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.452 -179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.834 HD22 ' HD2' ' B' ' 52' ' ' PRO . 1.3 t-20 157.38 117.58 0.0 OUTLIER Pre-proline 0 CA--C 1.529 0.163 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.479 -179.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.834 ' HD2' HD22 ' B' ' 51' ' ' ASN . 30.1 Cg_endo -63.01 170.1 8.03 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.369 2.046 . . . . 0.0 112.526 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 1.01 HG21 HG21 ' A' ' 67' ' ' THR . 0.6 OUTLIER -103.54 132.49 49.74 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 122.822 0.449 . . . . 0.0 110.544 0.041 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.774 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 46.4 m95 -101.62 104.66 15.52 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.574 -179.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.849 ' HE1' HG22 ' A' ' 67' ' ' THR . 37.1 m-70 -69.42 90.71 0.53 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.789 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 23.8 p -105.06 123.73 48.31 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 -178.059 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 1.078 HD12 ' HB2' ' A' ' 64' ' ' SER . 19.0 mm -118.08 108.28 24.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.088 178.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.042 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.4 p -111.07 120.91 62.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.868 0.366 . . . . 0.0 111.369 -179.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.639 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.77 -136.09 3.47 Favored Glycine 0 N--CA 1.447 -0.609 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.063 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.477 ' O ' ' OD1' ' B' ' 61' ' ' ASN . 0.4 OUTLIER -162.67 5.61 0.05 OUTLIER 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 120.873 0.368 . . . . 0.0 111.13 -179.568 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.477 ' OD1' ' O ' ' B' ' 60' ' ' ARG . 0.8 OUTLIER 171.18 31.8 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.949 179.93 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 1.071 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 0.1 OUTLIER -89.29 -170.4 2.85 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.024 -179.867 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.853 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -139.46 76.92 0.33 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.081 179.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.979 ' CB ' HD12 ' A' ' 57' ' ' ILE . 9.6 p -69.66 138.12 52.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.012 0.434 . . . . 0.0 111.191 -179.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.763 ' H ' HD13 ' A' ' 57' ' ' ILE . 68.3 t80 -146.24 88.55 1.8 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.34 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.828 HG21 ' CE1' ' B' ' 86' ' ' PHE . 10.2 m -125.74 145.68 32.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.348 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.779 HG21 ' CG2' ' A' ' 53' ' ' THR . 0.0 OUTLIER -80.13 70.05 6.66 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.632 179.796 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.548 ' CD2' ' HB2' ' B' ' 12' ' ' ASP . 1.6 p-80 -51.24 160.91 0.48 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.128 -179.733 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.533 ' O ' ' N ' ' B' ' 71' ' ' LYS . 0.8 OUTLIER -156.84 -144.75 0.14 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.768 -179.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.528 ' OG1' ' N ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 39.99 -90.52 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.833 179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.729 ' O ' ' HA ' ' B' ' 13' ' ' MET . 0.5 OUTLIER 163.21 21.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.885 179.938 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.495 ' HB3' ' CZ3' ' B' ' 54' ' ' TRP . 39.6 m80 -115.96 52.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.765 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.867 ' HD1' ' HB3' ' B' ' 86' ' ' PHE . 11.9 t80 -127.34 123.92 37.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.515 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 1.1 HG13 ' HB3' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -135.42 117.36 20.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.889 0.376 . . . . 0.0 111.537 179.888 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.566 ' HD1' ' N ' ' B' ' 76' ' ' PHE . 0.2 OUTLIER -103.35 134.74 46.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.007 178.972 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.961 ' HB3' HG13 ' B' ' 8' ' ' ILE . 0.5 OUTLIER -162.68 169.15 20.54 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.902 -179.813 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.568 ' O ' ' N ' ' B' ' 7' ' ' VAL . 49.4 t80 -135.38 115.77 13.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.756 -179.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 0.98 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.4 OUTLIER -68.77 169.99 10.32 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.763 -179.769 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.427 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -35.09 -35.46 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.742 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.403 ' N ' ' O ' ' B' ' 78' ' ' LEU . 1.4 pt20 -154.38 33.8 0.42 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.823 0.344 . . . . 0.0 111.134 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.63 HG12 ' N ' ' B' ' 82' ' ' ALA . 55.3 t -152.83 168.22 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.613 179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.918 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -131.62 152.29 50.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.819 0.343 . . . . 0.0 111.111 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.918 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -141.95 123.77 13.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.393 -179.628 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.924 HD23 HG12 ' B' ' 57' ' ' ILE . 0.4 OUTLIER -117.89 90.2 3.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.404 179.756 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.78 ' O ' ' HA ' ' B' ' 73' ' ' PHE . 0.8 OUTLIER -94.64 130.78 40.98 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.618 -179.442 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.867 ' HB3' ' HD1' ' B' ' 73' ' ' PHE . 16.8 p90 -169.01 132.53 1.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.476 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.774 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 1.2 mtpp -108.16 170.47 7.98 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.733 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.449 ' OG ' ' CB ' ' A' ' 88' ' ' SER . 0.2 OUTLIER -122.01 19.89 10.79 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.306 0.574 . . . . 0.0 110.998 179.916 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.084 0 CA-C-O 118.426 -1.208 . . . . 0.0 112.598 -179.919 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtp . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.817 0.341 . . . . 0.0 111.31 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -145.12 85.33 1.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.951 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.767 ' O ' ' HG2' ' A' ' 23' ' ' GLU . 1.3 m-20 -117.8 -133.25 0.32 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.083 -179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.86 ' HD2' ' HG2' ' A' ' 19' ' ' GLN . 0.0 OUTLIER -122.95 70.16 1.01 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.141 -179.823 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.592 ' O ' ' HG3' ' A' ' 5' ' ' LYS . 22.3 tptm -85.17 44.61 1.1 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.791 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.976 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -128.28 173.7 9.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.406 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.742 ' CG1' ' HE2' ' A' ' 9' ' ' LYS . 38.5 t -132.7 81.32 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.674 179.595 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.873 HG13 ' HB3' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -50.32 150.62 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.243 0 CA-C-O 120.978 0.418 . . . . 0.0 110.505 -179.956 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.762 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 0.0 OUTLIER -159.42 1.11 0.08 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.787 -179.771 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.821 ' HB3' ' HB3' ' A' ' 75' ' ' TYR . 0.1 OUTLIER -160.25 77.55 0.64 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.553 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.683 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -118.06 174.35 6.26 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 121.232 0.539 . . . . 0.0 111.879 -179.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.678 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 0.3 OUTLIER -174.03 28.51 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.333 -0.849 . . . . 0.0 109.398 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.86 ' H ' HE22 ' A' ' 18' ' ' GLN . 16.0 ttp -124.45 171.15 10.18 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.104 -0.953 . . . . 0.0 110.688 -179.462 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.706 ' H ' ' HG3' ' A' ' 13' ' ' MET . 0.4 OUTLIER -53.57 138.24 34.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.656 179.741 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -43.95 -67.14 0.3 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.952 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.52 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 0.0 OUTLIER -48.15 -34.13 9.46 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.94 -179.994 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.744 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 47.2 mmm -68.92 -29.83 68.18 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.862 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.981 ' HA ' HD12 ' A' ' 74' ' ' ILE . 1.6 mm100 -74.21 -39.09 63.35 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.654 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.86 ' HG2' ' HD2' ' A' ' 4' ' ' ARG . 6.9 mt-30 -74.83 -34.23 62.3 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.52 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.3 OUTLIER -73.53 -36.86 65.75 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.642 178.988 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.971 ' HB2' HD22 ' A' ' 85' ' ' LEU . 56.6 p -62.91 -47.38 83.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.835 178.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.972 HG23 ' O ' ' A' ' 18' ' ' GLN . 26.3 t -57.64 -49.97 78.88 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.766 179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.767 ' HG2' ' O ' ' A' ' 3' ' ' ASP . 40.9 mt-10 -55.14 -38.57 68.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.213 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.69 -37.39 84.65 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.187 179.256 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.717 ' HA ' ' CD1' ' A' ' 42' ' ' ILE . . . -70.93 -27.83 64.05 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 178.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.58 ' HA ' ' HB2' ' A' ' 29' ' ' LEU . 5.3 m -73.85 -39.99 63.61 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 114.323 -1.308 . . . . 0.0 109.355 178.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.59 ' O ' ' HG2' ' A' ' 31' ' ' LYS . 0.0 OUTLIER -56.51 -45.36 81.12 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.629 178.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.878 ' HB3' HG23 ' A' ' 38' ' ' ILE . . . -75.3 -23.38 57.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.752 178.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 1.062 HD21 HG11 ' A' ' 81' ' ' VAL . 7.0 mt -73.94 -34.02 64.15 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.846 179.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -94.17 -21.75 18.88 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.533 179.751 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.614 ' HB2' ' CE1' ' A' ' 32' ' ' TYR . 41.0 mmtm -90.1 -13.16 36.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.676 179.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.681 ' HD1' ' O ' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -152.26 -142.59 0.12 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.637 179.77 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.61 ' HA ' HD11 ' A' ' 38' ' ' ILE . 0.6 OUTLIER 159.88 34.6 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.501 179.796 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.949 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 33.2 mm -113.97 39.21 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.184 -179.862 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.787 ' N ' HD12 ' A' ' 38' ' ' ILE . 3.6 mp0 36.69 -87.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.54 -0.3 . . . . 0.0 110.58 -179.65 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.677 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 0.0 OUTLIER -42.06 -43.42 3.22 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.896 0.379 . . . . 0.0 110.378 179.382 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.949 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 1.9 t70 -60.45 -57.62 11.96 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.335 179.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.878 HG23 ' HB3' ' A' ' 28' ' ' ALA . 3.2 mt -48.3 -55.28 3.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.856 179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 1.057 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -53.1 -46.65 68.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.88 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.717 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -52.03 -54.56 28.55 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.054 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.552 ' HD1' ' HB1' ' A' ' 28' ' ' ALA . 0.2 OUTLIER -60.82 -55.21 35.78 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.737 179.981 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.748 HD11 HG22 ' A' ' 38' ' ' ILE . 76.3 mt -44.31 -56.73 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.137 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.84 ' HD2' ' HE2' ' B' ' 65' ' ' TYR . 0.2 OUTLIER -53.42 -68.94 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.754 179.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.579 ' HA ' ' OD2' ' A' ' 47' ' ' ASP . 0.0 OUTLIER -35.61 -53.81 0.69 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.725 179.955 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.565 ' O ' ' N ' ' A' ' 49' ' ' LYS . 1.2 mm-40 -51.37 -58.94 4.88 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.78 179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.743 ' HB3' ' CG ' ' A' ' 54' ' ' TRP . 3.0 m-85 -52.35 -48.6 65.43 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.786 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.801 ' HB2' ' HB3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -61.54 -19.25 61.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.653 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.34 12.3 10.9 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.782 179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.565 ' N ' ' O ' ' A' ' 45' ' ' GLU . 1.0 OUTLIER -124.44 -16.87 6.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.096 -179.875 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.701 ' O ' ' HB2' ' A' ' 51' ' ' ASN . 27.1 m-85 -140.1 -55.36 0.54 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.801 0.334 . . . . 0.0 111.238 -179.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.701 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 3.5 t30 160.1 119.77 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.169 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.314 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.801 ' HB3' ' HB2' ' A' ' 47' ' ' ASP . 39.4 Cg_endo -67.02 166.87 21.47 Favored 'Trans proline' 0 CA--C 1.532 0.399 0 C-N-CA 122.464 2.109 . . . . 0.0 112.344 -179.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.811 HG22 ' CE1' ' A' ' 55' ' ' HIS . 3.7 m -106.64 128.28 54.04 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 122.817 0.447 . . . . 0.0 110.77 0.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.796 ' CE2' ' HD2' ' A' ' 87' ' ' LYS . 57.7 m95 -94.64 123.38 38.04 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.856 -179.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.892 ' HB3' ' HB ' ' B' ' 66' ' ' VAL . 0.0 OUTLIER -106.9 97.69 7.44 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 178.588 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.882 ' HB2' HD12 ' A' ' 85' ' ' LEU . 27.7 p -117.5 162.37 18.09 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -177.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.93 ' HB ' ' HB3' ' A' ' 84' ' ' LEU . 16.5 mm -129.47 168.48 22.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.01 178.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 1.057 HG12 ' HB2' ' A' ' 39' ' ' ALA . 5.9 p -165.04 110.84 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.899 0.38 . . . . 0.0 111.479 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.792 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -146.48 -128.14 1.9 Allowed Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 120.858 -0.687 . . . . 0.0 112.205 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.564 ' HG3' ' NH1' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -167.14 -37.67 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.494 0 CA-C-O 120.785 0.326 . . . . 0.0 111.121 -179.755 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -140.16 52.61 1.67 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.247 -179.728 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 1.053 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 0.4 OUTLIER -110.11 168.46 9.42 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.886 0.374 . . . . 0.0 110.758 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.901 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -115.1 81.31 0.3 Allowed Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.838 -0.696 . . . . 0.0 111.959 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.927 ' HA ' HG12 ' B' ' 57' ' ' ILE . 1.0 OUTLIER -76.06 137.95 40.52 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.968 0.414 . . . . 0.0 111.472 -179.461 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.742 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 9.1 t80 -151.16 65.61 0.9 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.42 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.678 ' HB ' ' HB3' ' B' ' 55' ' ' HIS . 28.5 m -112.78 161.74 11.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.187 -179.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.767 HG23 ' N ' ' A' ' 68' ' ' HIS . 2.8 t -81.65 -149.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.952 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.767 ' N ' HG23 ' A' ' 67' ' ' THR . 5.7 p-80 179.59 161.2 0.83 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.711 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -161.64 165.07 28.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.332 -0.394 . . . . 0.0 111.041 -179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.456 ' O ' ' HB3' ' A' ' 71' ' ' LYS . 9.1 m 68.72 -93.6 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.126 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.599 ' HA ' ' O ' ' A' ' 12' ' ' ASP . 0.0 OUTLIER 168.3 67.16 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.862 -179.765 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.858 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 95.9 m-70 -154.73 16.73 0.45 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.845 -179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.988 ' HA ' ' HA ' ' A' ' 86' ' ' PHE . 8.8 t80 -99.4 101.0 12.13 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.37 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.981 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -123.56 118.87 55.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.958 0.408 . . . . 0.0 111.595 -179.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.821 ' HB3' ' HB3' ' A' ' 10' ' ' ASN . 75.9 t80 -112.76 135.03 53.97 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.111 179.35 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.873 ' HB3' HG13 ' A' ' 8' ' ' ILE . 0.2 OUTLIER -150.13 176.55 10.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.877 0.37 . . . . 0.0 111.203 -179.493 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.778 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 7.2 t80 -132.4 99.45 4.68 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.19 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.976 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 1.9 mm? -65.24 -174.83 0.19 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.329 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.46 ' O ' ' CB ' ' A' ' 80' ' ' GLN . . . -60.18 85.4 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.062 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.778 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 5.7 tt0 82.68 12.31 0.52 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.807 0.337 . . . . 0.0 110.739 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 1.062 HG11 HD21 ' A' ' 29' ' ' LEU . 68.5 t -136.09 173.58 13.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.853 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.807 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -148.99 154.67 39.7 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.858 0.361 . . . . 0.0 111.142 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.807 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.4 OUTLIER -139.95 116.08 8.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.037 -179.9 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.93 ' HB3' ' HB ' ' A' ' 57' ' ' ILE . 12.6 tp -97.98 86.52 3.75 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.785 179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.971 HD22 ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -90.48 139.24 30.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.051 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.988 ' HA ' ' HA ' ' A' ' 73' ' ' PHE . 1.0 OUTLIER -172.53 121.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.355 179.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.857 ' HB2' ' HB2' ' A' ' 72' ' ' HIS . 0.8 OUTLIER -94.21 118.99 32.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.792 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.864 ' HB2' ' NE2' ' A' ' 55' ' ' HIS . 0.4 OUTLIER -85.37 18.98 2.45 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.311 0.576 . . . . 0.0 110.784 -179.987 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.35 -1.25 . . . . 0.0 112.533 179.876 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.599 ' C ' ' SG ' ' B' ' 2' ' ' CYS . 13.6 mtm . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.797 0.332 . . . . 0.0 111.203 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.599 ' SG ' ' C ' ' B' ' 1' ' ' MET . 0.0 OUTLIER -167.9 81.31 0.18 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.91 179.954 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.444 ' HB2' ' OE2' ' B' ' 23' ' ' GLU . 4.0 m-20 -145.2 -4.39 0.71 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.042 -179.945 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.674 ' HD2' ' OE1' ' B' ' 19' ' ' GLN . 0.0 OUTLIER -80.32 66.43 5.82 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.765 179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . . . . . . . . . 2.5 tmtt? -89.99 36.08 0.86 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.073 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.071 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . -110.52 -155.33 0.56 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.055 179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.563 ' N ' ' O ' ' B' ' 77' ' ' TYR . 6.8 t -158.36 67.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.134 179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.896 HG13 ' HB3' ' B' ' 76' ' ' PHE . 1.1 mp -35.66 142.84 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 120.968 0.413 . . . . 0.0 110.153 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 1.008 ' HE2' ' HA ' ' B' ' 9' ' ' LYS . 5.2 mmpt? -120.86 -22.41 6.24 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.463 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.598 ' C ' HD22 ' B' ' 10' ' ' ASN . 0.2 OUTLIER -150.21 -104.45 0.07 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.308 179.758 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.755 ' CB ' ' HA ' ' B' ' 74' ' ' ILE . . . 69.25 145.34 0.05 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.176 0.512 . . . . 0.0 111.743 179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.565 ' HB3' ' HB3' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -145.17 25.49 1.39 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.647 179.216 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.648 ' HG2' ' HB2' ' B' ' 17' ' ' MET . 20.1 ttp -102.04 166.47 10.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.263 -0.88 . . . . 0.0 110.989 -179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.733 ' HB2' ' HG3' ' B' ' 17' ' ' MET . 2.2 m -47.68 143.52 3.82 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.814 179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 3.4 pt-20 -49.84 -69.61 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.864 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.761 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -47.34 -21.31 0.28 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.763 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.733 ' HG3' ' HB2' ' B' ' 14' ' ' SER . 0.0 OUTLIER -82.39 -37.73 25.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.017 179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 0.99 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -72.26 -34.72 68.45 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.659 179.869 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.674 ' OE1' ' HD2' ' B' ' 4' ' ' ARG . 37.7 mt-30 -77.86 -40.42 40.23 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.927 179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.761 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.2 OUTLIER -69.15 -33.44 73.42 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.681 -0.691 . . . . 0.0 109.638 179.161 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.869 ' HB2' HD22 ' B' ' 85' ' ' LEU . 0.6 OUTLIER -65.48 -49.28 69.66 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.154 179.286 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.984 HG22 ' CD2' ' B' ' 76' ' ' PHE . 84.1 t -59.94 -37.11 70.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.162 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . 0.588 ' HG3' ' O ' ' B' ' 19' ' ' GLN . 62.2 mt-10 -63.86 -35.05 79.37 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.344 179.576 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.502 ' O ' ' HG3' ' B' ' 27' ' ' GLN . 3.5 t -72.82 -34.61 66.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.1 0.476 . . . . 0.0 109.798 179.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.741 ' HA ' ' CD1' ' B' ' 42' ' ' ILE . . . -72.63 -35.04 67.71 Favored 'General case' 0 CA--C 1.513 -0.467 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.924 ' HA ' HD12 ' B' ' 29' ' ' LEU . 51.7 m -69.83 -43.89 71.05 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 114.424 -1.262 . . . . 0.0 109.622 178.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.813 ' HG3' ' N ' ' B' ' 28' ' ' ALA . 0.0 OUTLIER -52.73 -46.84 67.58 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.526 178.975 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.813 ' N ' ' HG3' ' B' ' 27' ' ' GLN . . . -71.28 -24.14 62.1 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.721 178.793 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.924 HD12 ' HA ' ' B' ' 26' ' ' THR . 3.5 mt -71.34 -36.82 71.66 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.543 179.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -86.74 -28.83 22.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.625 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.779 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 44.7 mmtm -84.25 -27.61 27.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.783 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.766 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -148.87 164.49 34.32 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.662 179.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.49 ' C ' HD13 ' B' ' 34' ' ' ILE . 9.7 m120 -129.65 31.25 4.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.794 179.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 1.053 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 2.2 mm -113.7 107.1 22.07 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.085 -179.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.901 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 13.9 mp0 -31.15 -67.64 0.09 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.545 179.865 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.416 ' H ' ' HG3' ' B' ' 36' ' ' LYS . 0.0 OUTLIER -48.57 -60.69 2.5 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.789 179.594 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 1.053 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.2 m-20 -45.29 -65.1 0.58 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.664 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.829 ' HB ' HG11 ' B' ' 58' ' ' VAL . 9.9 mt -41.91 -46.74 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.127 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 1.047 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -64.88 -42.46 94.8 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.984 179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.742 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -57.85 -59.44 5.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.156 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.697 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.0 OUTLIER -53.53 -55.06 28.74 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.661 179.985 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.81 HD11 HG22 ' B' ' 38' ' ' ILE . 37.7 mt -45.5 -69.35 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.118 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.698 ' HD2' ' HE2' ' A' ' 65' ' ' TYR . 4.4 tmtt? -45.21 -36.45 3.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.898 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.511 ' O ' ' HE2' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -65.94 -50.01 65.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.977 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.769 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 0.8 OUTLIER -64.86 -35.88 82.56 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.912 -179.947 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.798 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.3 OUTLIER -68.61 -40.52 80.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.029 -179.86 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.78 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -67.43 -39.07 85.43 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.899 -179.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.95 -32.37 34.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.842 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.769 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -88.82 -13.28 39.71 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.367 -179.776 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.722 ' O ' ' HB2' ' B' ' 51' ' ' ASN . 98.6 m-85 -123.58 -73.23 0.65 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.48 -179.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.722 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 2.6 t-20 159.21 113.15 0.0 OUTLIER Pre-proline 0 C--N 1.332 -0.172 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.78 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 78.5 Cg_exo -42.13 151.06 0.21 Allowed 'Trans proline' 0 N--CA 1.458 -0.589 0 C-N-CA 122.208 1.939 . . . . 0.0 112.355 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.759 HG23 ' CE1' ' B' ' 55' ' ' HIS . 2.8 t -122.41 131.84 54.08 Favored 'General case' 0 C--N 1.341 0.239 0 C-N-CA 122.895 0.478 . . . . 0.0 110.51 0.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 1.019 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 53.3 m95 -96.16 126.01 41.09 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.716 -179.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.759 ' CE1' HG23 ' B' ' 53' ' ' THR . 0.0 OUTLIER -98.13 94.08 6.62 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.092 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 1.039 ' HB3' HD12 ' B' ' 85' ' ' LEU . 1.8 m -112.61 169.68 8.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.437 0.637 . . . . 0.0 112.015 -177.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.935 HD12 HD23 ' B' ' 84' ' ' LEU . 32.8 mt -158.34 162.19 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.346 179.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.047 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.2 p -159.54 114.83 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-O 121.003 0.43 . . . . 0.0 111.488 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.816 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -143.2 -133.92 2.82 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.893 -0.67 . . . . 0.0 111.942 179.753 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.404 ' H ' ' H ' ' B' ' 61' ' ' ASN . 5.3 ptm180 -172.88 10.03 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.778 0.323 . . . . 0.0 111.168 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.44 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -174.62 32.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.216 -179.908 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 1.053 ' HB3' ' HB3' ' A' ' 62' ' ' PHE . 8.8 p90 -102.81 168.34 9.29 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.05 0.452 . . . . 0.0 111.142 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 58' ' ' VAL . . . -121.79 81.84 0.35 Allowed Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.064 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.923 ' HA ' HG23 ' A' ' 57' ' ' ILE . 8.7 p -75.88 123.27 25.4 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.959 0.409 . . . . 0.0 111.324 -179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.84 ' HE2' ' HD2' ' A' ' 43' ' ' LYS . 10.8 t80 -134.85 68.88 1.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.507 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.904 HG21 ' CE1' ' B' ' 86' ' ' PHE . 4.6 m -114.88 150.99 16.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.457 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . . . . . . . . . 16.3 m -87.37 95.99 10.2 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.857 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.807 ' HB2' ' O ' ' B' ' 72' ' ' HIS . 10.6 p-80 -61.87 159.08 14.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.122 -179.897 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.573 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.5 OUTLIER -152.65 -171.6 3.98 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.614 179.98 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.593 HG22 ' HG2' ' B' ' 71' ' ' LYS . 29.8 m 51.68 -119.54 1.47 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.413 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.593 ' HG2' HG22 ' B' ' 70' ' ' THR . 55.5 mmtt -72.95 31.89 0.07 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.059 0.457 . . . . 0.0 110.202 179.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.807 ' O ' ' HB2' ' B' ' 68' ' ' HIS . 63.2 m-70 61.49 -93.67 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.496 -179.835 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.793 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.1 OUTLIER 159.4 -161.06 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.818 179.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.99 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.5 OUTLIER -165.3 111.66 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.049 179.24 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.549 ' HE1' ' HZ ' ' B' ' 62' ' ' PHE . 9.6 t80 -110.12 98.27 7.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.609 179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.984 ' CD2' HG22 ' B' ' 22' ' ' VAL . 3.6 p90 -118.58 169.67 9.6 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.311 -179.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.67 ' HD2' ' HB2' ' B' ' 82' ' ' ALA . 31.2 t80 -132.27 113.21 12.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.522 179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.071 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 1.1 mm? -70.39 169.87 13.06 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.73 -179.816 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.516 ' C ' ' HG2' ' B' ' 80' ' ' GLN . . . -24.76 -47.63 0.02 OUTLIER Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.117 -0.564 . . . . 0.0 113.218 -179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.516 ' HG2' ' C ' ' B' ' 79' ' ' GLY . 1.2 mt-30 -145.71 29.83 1.11 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.644 0.259 . . . . 0.0 111.142 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.816 HG13 ' O ' ' B' ' 59' ' ' GLY . 97.1 t -143.61 170.11 10.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.285 -179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.771 ' O ' ' HA ' ' B' ' 58' ' ' VAL . . . -137.1 126.09 24.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.552 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.658 HG21 ' HB2' ' B' ' 25' ' ' ALA . 0.3 OUTLIER -114.66 124.05 70.94 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-O 121.134 0.493 . . . . 0.0 111.832 -179.399 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.935 HD23 HD12 ' B' ' 57' ' ' ILE . 0.2 OUTLIER -106.85 93.96 4.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.039 179.655 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 1.039 HD12 ' HB3' ' B' ' 56' ' ' CYS . 0.5 OUTLIER -100.43 122.86 43.85 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.276 -179.414 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.904 ' CE1' HG21 ' B' ' 66' ' ' VAL . 18.3 p90 -163.83 115.06 1.36 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.319 179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 1.019 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 5.6 ptmt -105.02 158.32 16.63 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.684 179.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.573 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 0.6 OUTLIER -95.52 19.45 10.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.229 0.538 . . . . 0.0 110.869 -179.97 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . 0.745 ' HA2' ' CE ' ' B' ' 87' ' ' LYS . . . . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.372 -1.238 . . . . 0.0 112.47 179.984 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.854 0.359 . . . . 0.0 111.119 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 4.5 t 64.97 156.43 0.08 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.728 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -84.72 -149.91 0.12 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.78 179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.442 HH11 ' HD3' ' A' ' 4' ' ' ARG . 0.0 OUTLIER -98.37 -46.58 5.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.874 -179.972 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.62 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.1 OUTLIER 39.06 38.87 0.34 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.17 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.045 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -141.67 173.34 11.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.244 -179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.47 ' HB ' ' HB3' ' A' ' 77' ' ' TYR . 39.0 t -139.05 75.78 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.033 179.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.828 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.9 OUTLIER -38.89 160.47 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 CA-C-O 121.13 0.49 . . . . 0.0 110.637 179.997 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.734 ' HD3' ' O ' ' A' ' 8' ' ' ILE . 2.8 mmtp -159.44 -6.96 0.06 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.63 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.477 ' CG ' ' HZ ' ' A' ' 73' ' ' PHE . 0.4 OUTLIER -167.51 71.03 0.1 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.393 179.984 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.877 ' HA ' ' HA ' ' A' ' 74' ' ' ILE . . . -117.5 92.36 3.82 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.664 -179.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.811 ' HB3' ' ND1' ' A' ' 72' ' ' HIS . 53.7 m-20 -90.53 26.41 2.0 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.154 0.502 . . . . 0.0 110.246 179.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.775 ' HG3' ' H ' ' A' ' 14' ' ' SER . 16.0 ttp -109.85 173.33 6.37 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.641 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.775 ' H ' ' HG3' ' A' ' 13' ' ' MET . 1.2 t -57.91 140.85 51.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.86 179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.571 ' HA ' ' CG ' ' A' ' 18' ' ' GLN . 11.9 mt-10 -47.98 -62.91 1.23 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.967 -179.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' A' ' 20' ' ' ASP . 1.1 mt-10 -51.68 -31.62 26.57 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.852 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.566 ' SD ' ' HD3' ' A' ' 71' ' ' LYS . 0.0 OUTLIER -72.57 -45.59 58.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.898 -179.996 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 1.007 ' HA ' HD12 ' A' ' 74' ' ' ILE . 0.0 OUTLIER -62.4 -36.86 83.66 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.943 179.957 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.549 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 10.2 mt-30 -73.57 -35.17 65.43 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 179.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.483 ' HB2' ' O ' ' A' ' 16' ' ' GLU . 0.4 OUTLIER -74.05 -27.74 61.07 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.557 -0.747 . . . . 0.0 109.699 178.917 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.829 ' HA ' ' CE2' ' A' ' 46' ' ' PHE . 1.4 t -71.22 -41.03 70.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.06 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.958 HG22 ' CD2' ' A' ' 76' ' ' PHE . 94.7 t -65.58 -46.67 88.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.613 179.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.719 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 58.2 mt-10 -57.97 -41.7 83.46 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.114 179.399 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 20.3 m -64.35 -37.04 86.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.989 -0.551 . . . . 0.0 109.758 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.891 ' O ' HD12 ' A' ' 29' ' ' LEU . . . -69.99 -32.56 70.82 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 178.221 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 22' ' ' VAL . 1.6 m -69.27 -38.82 78.56 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-N 114.351 -1.295 . . . . 0.0 109.47 178.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.775 ' O ' ' HB2' ' A' ' 31' ' ' LYS . 57.5 mt-30 -59.22 -41.01 87.64 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.943 179.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.99 ' HB1' ' HA ' ' A' ' 38' ' ' ILE . . . -73.21 -31.72 64.35 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.132 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.891 HD12 ' O ' ' A' ' 25' ' ' ALA . 1.3 mt -72.13 -35.68 69.18 Favored 'General case' 0 N--CA 1.453 -0.279 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.327 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -93.17 -11.78 31.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.352 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.775 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 8.4 mttm -96.43 -19.82 18.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.723 0.297 . . . . 0.0 111.216 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.594 ' HE1' ' ND1' ' A' ' 41' ' ' HIS . 0.1 OUTLIER -151.46 -62.77 0.18 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.031 179.955 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.935 ' HA ' HD11 ' A' ' 38' ' ' ILE . 5.7 t-20 74.83 61.12 0.07 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.75 -179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.057 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 44.3 mm -141.21 57.92 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.011 -179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.617 ' O ' HG13 ' A' ' 58' ' ' VAL . 1.5 mp0 31.87 -91.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.974 0.416 . . . . 0.0 110.266 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.673 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.0 OUTLIER -44.02 -54.03 5.79 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.031 -0.532 . . . . 0.0 110.214 179.105 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 1.057 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.2 OUTLIER -52.26 -58.29 7.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.978 179.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.99 ' HA ' ' HB1' ' A' ' 28' ' ' ALA . 24.5 mt -48.22 -43.42 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.939 179.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.896 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -62.22 -49.62 75.01 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.765 179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.815 ' HA ' ' CD2' ' B' ' 65' ' ' TYR . . . -53.26 -45.74 68.95 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.776 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.827 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.4 OUTLIER -57.2 -58.44 8.22 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.747 -0.66 . . . . 0.0 110.622 179.851 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.917 HG21 HD11 ' A' ' 85' ' ' LEU . 8.0 mt -50.42 -74.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.367 -179.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.721 ' HD3' ' CD2' ' B' ' 65' ' ' TYR . 7.6 tttt -39.11 -40.62 0.72 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.379 -0.373 . . . . 0.0 110.799 -179.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.587 ' HB2' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -53.21 -62.36 1.7 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.038 -179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 49' ' ' LYS . 0.5 OUTLIER -60.48 -58.95 6.3 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.871 -179.98 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.829 ' CE2' ' HA ' ' A' ' 21' ' ' SER . 0.9 OUTLIER -42.02 -38.19 1.57 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.744 179.803 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.769 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 0.0 OUTLIER -69.35 -43.74 73.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.837 -179.855 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.998 ' HA ' ' HE3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -95.94 9.78 39.51 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.316 -179.844 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.495 ' N ' ' O ' ' A' ' 45' ' ' GLU . 0.0 OUTLIER -129.96 -5.54 4.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.365 -0.379 . . . . 0.0 111.119 -179.9 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.793 ' HD1' ' HA ' ' A' ' 46' ' ' PHE . 75.9 m-85 -138.39 -61.89 0.58 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.224 -179.78 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.5 ' HB2' ' O ' ' A' ' 50' ' ' TYR . 0.6 OUTLIER 158.8 109.62 0.0 OUTLIER Pre-proline 0 C--N 1.331 -0.21 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.223 -179.708 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.769 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 51.7 Cg_exo -54.23 148.81 39.26 Favored 'Trans proline' 0 CA--C 1.53 0.317 0 C-N-CA 122.39 2.06 . . . . 0.0 112.734 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.892 ' CG2' HG21 ' B' ' 67' ' ' THR . 0.2 OUTLIER -117.42 144.12 45.31 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.882 0.473 . . . . 0.0 110.731 -0.021 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.651 ' HA ' ' HB3' ' A' ' 87' ' ' LYS . 70.7 m95 -101.19 114.88 29.25 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.499 -179.69 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.807 ' HB2' ' CE1' ' A' ' 86' ' ' PHE . 0.0 OUTLIER -86.3 92.31 8.76 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 178.812 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 1.055 ' HB3' HD12 ' A' ' 85' ' ' LEU . 0.4 OUTLIER -106.81 144.36 33.56 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.233 0.539 . . . . 0.0 112.293 -178.412 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.046 HD11 HG13 ' B' ' 66' ' ' VAL . 14.5 mm -132.81 107.41 11.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.341 179.02 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.896 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.1 p -107.47 129.93 60.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.954 0.407 . . . . 0.0 111.479 -179.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.764 ' O ' HG13 ' A' ' 81' ' ' VAL . . . -154.98 -127.07 1.06 Allowed Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.057 179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.508 ' O ' ' HE2' ' A' ' 77' ' ' TYR . 0.0 OUTLIER -160.56 -54.48 0.05 Allowed 'General case' 0 N--CA 1.451 -0.402 0 CA-C-O 120.746 0.307 . . . . 0.0 111.23 -179.956 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.814 ' HB3' ' CZ ' ' B' ' 60' ' ' ARG . 0.1 OUTLIER -130.94 67.54 1.51 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.084 -179.792 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.814 ' HE2' ' HB3' ' A' ' 64' ' ' SER . 1.4 p90 -122.57 -166.02 1.37 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.872 0.368 . . . . 0.0 110.861 179.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.601 ' N ' ' O ' ' B' ' 58' ' ' VAL . . . -138.07 75.51 0.38 Allowed Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.029 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.814 ' HA ' HG23 ' B' ' 57' ' ' ILE . 73.8 p -67.86 133.71 49.63 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.828 0.347 . . . . 0.0 111.177 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.877 ' HD2' ' HG2' ' B' ' 43' ' ' LYS . 16.1 t80 -151.42 79.54 1.29 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.897 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.955 HG21 ' CD1' ' A' ' 86' ' ' PHE . 21.2 m -110.09 176.67 1.44 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.039 179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.786 ' HB ' ' CE1' ' B' ' 55' ' ' HIS . 55.1 m -107.01 108.97 20.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.83 179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.625 ' HB2' ' HA ' ' A' ' 72' ' ' HIS . 0.0 OUTLIER -57.89 157.39 7.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.883 179.938 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.725 ' HG3' ' HA ' ' A' ' 88' ' ' SER . 9.9 mm-40 -136.96 -125.09 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.923 179.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.482 ' O ' ' O ' ' A' ' 69' ' ' GLU . 0.2 OUTLIER -30.18 -97.61 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.225 -179.879 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.566 ' HD3' ' SD ' ' A' ' 17' ' ' MET . 0.1 OUTLIER -78.94 46.55 0.7 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.521 -179.972 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.811 ' ND1' ' HB3' ' A' ' 12' ' ' ASP . 18.8 m170 47.48 -90.48 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.623 -179.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.749 ' HB3' ' O ' ' A' ' 72' ' ' HIS . 4.7 p90 163.13 -160.04 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.594 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 1.007 HD12 ' HA ' ' A' ' 18' ' ' GLN . 0.5 OUTLIER -168.08 129.8 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.581 179.743 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.556 ' CE1' ' HB2' ' A' ' 84' ' ' LEU . 15.4 t80 -123.19 136.14 54.61 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.612 178.718 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.958 ' CD2' HG22 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -154.57 168.87 25.31 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.996 0.427 . . . . 0.0 111.193 -179.314 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.704 ' HA ' ' HA ' ' A' ' 82' ' ' ALA . 11.7 t80 -127.1 99.09 5.55 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.187 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.045 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.8 OUTLIER -65.91 -175.06 0.27 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.559 179.76 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.451 ' O ' ' HB3' ' A' ' 80' ' ' GLN . . . -58.11 86.78 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.56 -0.829 . . . . 0.0 111.978 179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.451 ' HB3' ' O ' ' A' ' 79' ' ' GLY . 48.0 tt0 78.01 23.25 0.76 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.078 0.466 . . . . 0.0 110.195 -179.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.764 HG13 ' O ' ' A' ' 59' ' ' GLY . 45.5 t -141.97 167.13 16.08 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.782 -179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.806 ' HB3' ' HE1' ' A' ' 62' ' ' PHE . . . -146.43 118.58 8.3 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.723 179.727 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.795 ' HB ' ' CZ ' ' A' ' 76' ' ' PHE . 0.5 OUTLIER -105.11 139.99 24.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-O 120.973 0.416 . . . . 0.0 111.609 -179.53 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.974 HD23 HG12 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -124.7 94.53 4.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.378 179.644 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 1.055 HD12 ' HB3' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -99.6 129.14 45.73 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.556 -179.318 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.955 ' CD1' HG21 ' A' ' 66' ' ' VAL . 1.4 p90 -166.32 119.37 1.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.909 179.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.651 ' HB3' ' HA ' ' A' ' 54' ' ' TRP . 0.5 OUTLIER -105.82 151.79 24.06 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.067 -179.949 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.725 ' HA ' ' HG3' ' A' ' 69' ' ' GLU . 0.1 OUTLIER -98.4 18.33 16.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.175 0.512 . . . . 0.0 110.809 179.925 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.454 -1.192 . . . . 0.0 112.474 -179.976 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.872 ' HG2' ' H ' ' B' ' 2' ' ' CYS . 28.6 ttm . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.873 0.368 . . . . 0.0 111.233 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.872 ' H ' ' HG2' ' B' ' 1' ' ' MET . 5.1 m -91.17 179.15 5.79 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.894 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . 0.623 ' HB2' ' O ' ' B' ' 2' ' ' CYS . 1.2 m-20 75.32 176.5 0.22 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.73 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.578 ' NH1' ' HG3' ' B' ' 4' ' ' ARG . 3.2 mmm-85 -37.78 -96.36 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.937 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.662 ' O ' HD13 ' B' ' 78' ' ' LEU . 0.0 OUTLIER 77.62 98.27 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.689 -179.869 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 1.051 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 159.03 -168.97 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.767 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.691 ' CG1' ' HE2' ' B' ' 9' ' ' LYS . 99.5 t -152.78 75.8 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.252 179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.98 HG13 ' HB3' ' B' ' 76' ' ' PHE . 0.7 OUTLIER -51.01 145.56 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-O 121.114 0.483 . . . . 0.0 110.419 179.805 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.691 ' HE2' ' CG1' ' B' ' 7' ' ' VAL . 0.5 OUTLIER -142.16 -10.3 0.87 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.156 179.965 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.551 ' CG ' ' HZ ' ' B' ' 73' ' ' PHE . 0.2 OUTLIER -162.54 72.12 0.33 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.564 -179.99 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.788 ' CB ' HG13 ' B' ' 74' ' ' ILE . . . -113.05 90.53 3.37 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.543 -179.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.685 ' HB2' ' HB3' ' B' ' 72' ' ' HIS . 21.5 m-20 -90.92 26.96 1.94 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.1 0.476 . . . . 0.0 110.334 179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.741 ' HG3' ' H ' ' B' ' 14' ' ' SER . 13.7 ttp -111.2 170.63 7.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.89 -179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.851 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 40.8 t -53.84 128.57 30.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.664 179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.716 ' O ' ' HG2' ' B' ' 18' ' ' GLN . 20.1 mt-10 -37.63 -68.99 0.13 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.896 -179.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -46.51 -27.7 1.19 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.827 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.851 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -73.88 -45.77 48.81 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.976 -179.992 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 1.024 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -62.18 -30.03 70.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.812 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.551 ' HG2' ' HD3' ' B' ' 4' ' ' ARG . 74.5 mt-30 -77.84 -41.59 36.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.052 0.453 . . . . 0.0 109.908 179.504 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.469 ' HB3' ' OH ' ' B' ' 50' ' ' TYR . 0.2 OUTLIER -69.24 -29.26 67.14 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.712 179.177 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.845 ' HA ' ' CE2' ' B' ' 46' ' ' PHE . 13.9 t -68.72 -48.7 63.16 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.184 179.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.888 HG22 ' CD2' ' B' ' 76' ' ' PHE . 74.2 t -57.58 -43.8 83.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.404 179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -61.5 -35.35 77.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.09 -0.505 . . . . 0.0 109.806 179.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . . . . . . . . . 90.9 m -71.35 -35.22 71.09 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.738 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.765 ' HA ' HG12 ' B' ' 42' ' ' ILE . . . -71.61 -32.25 67.8 Favored 'General case' 0 CA--C 1.512 -0.482 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 178.155 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.519 ' HA ' HD12 ' B' ' 29' ' ' LEU . 90.9 m -72.1 -42.23 66.35 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 114.372 -1.286 . . . . 0.0 109.663 178.603 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.584 ' O ' ' HG2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -52.72 -46.42 67.38 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.241 178.811 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.908 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -64.76 -38.18 90.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.887 178.726 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.714 HD12 ' O ' ' B' ' 25' ' ' ALA . 1.4 mt -64.07 -33.23 75.28 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.617 179.573 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -78.71 -32.09 46.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.764 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.584 ' HG2' ' O ' ' B' ' 27' ' ' GLN . 5.8 mmtt -85.54 -19.91 30.42 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.654 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.537 ' CE1' ' HB2' ' B' ' 31' ' ' LYS . 0.0 OUTLIER -165.98 164.37 18.34 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.776 179.677 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . . . . . . . . . 14.5 t30 -124.55 27.99 6.74 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.756 179.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.848 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.7 mm -104.5 107.86 23.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.938 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.781 ' HA ' HD12 ' B' ' 38' ' ' ILE . 0.9 OUTLIER -30.31 -70.65 0.05 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.922 -179.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.501 ' H ' ' HG2' ' B' ' 36' ' ' LYS . 1.8 mmmt -44.71 -49.26 10.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.654 179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.848 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 0.4 OUTLIER -55.89 -61.02 2.65 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.702 179.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 1.059 ' HB ' HG11 ' B' ' 58' ' ' VAL . 2.5 mt -46.22 -56.86 1.07 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.931 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 0.88 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -44.83 -46.69 10.84 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.606 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.871 ' HB2' ' CE1' ' A' ' 65' ' ' TYR . . . -65.24 -65.49 0.67 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.004 -0.543 . . . . 0.0 110.436 179.412 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.624 ' CD2' ' HB2' ' B' ' 28' ' ' ALA . 1.8 t60 -37.09 -34.97 0.09 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.76 179.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 1.019 HG21 HD11 ' B' ' 85' ' ' LEU . 39.5 mt -73.46 -66.72 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.938 179.758 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.877 ' HG2' ' HD2' ' A' ' 65' ' ' TYR . 0.0 OUTLIER -48.5 -24.02 1.16 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.503 179.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.519 ' N ' ' HD3' ' B' ' 43' ' ' LYS . 2.7 tttm -74.89 -58.38 3.32 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.793 179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.785 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 4.1 mt-10 -62.84 -30.67 71.68 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.68 179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.845 ' CE2' ' HA ' ' B' ' 21' ' ' SER . 0.6 OUTLIER -69.88 -43.29 72.1 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.836 179.831 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.806 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 0.0 OUTLIER -63.22 -36.99 85.49 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.129 -179.779 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . . . . . . . . . 2.3 mmmt -89.94 -24.07 21.4 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.714 -179.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.785 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.46 -13.19 35.32 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -179.402 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.608 ' CE2' ' HE1' ' B' ' 17' ' ' MET . 2.6 m-85 -126.75 -71.59 0.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.861 0.319 . . . . 0.0 111.861 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.461 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 3.7 m-20 162.02 113.8 0.01 OUTLIER Pre-proline 0 N--CA 1.453 -0.309 0 N-CA-C 109.677 -0.49 . . . . 0.0 109.677 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.806 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 44.7 Cg_exo -35.63 148.25 0.05 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.523 2.149 . . . . 0.0 112.7 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.694 ' O ' ' HB3' ' B' ' 87' ' ' LYS . 2.1 m -123.98 136.73 54.49 Favored 'General case' 0 C--N 1.341 0.238 0 C-N-CA 123.102 0.561 . . . . 0.0 110.258 -0.145 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.776 ' CE2' ' HD2' ' B' ' 87' ' ' LYS . 62.5 m95 -103.03 129.0 49.66 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.211 0.529 . . . . 0.0 112.254 -178.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.822 ' NE2' ' HB2' ' B' ' 88' ' ' SER . 7.8 m-70 -112.33 115.88 29.46 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 107.83 -1.174 . . . . 0.0 107.83 177.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.944 ' HB3' HD12 ' B' ' 85' ' ' LEU . 0.0 OUTLIER -134.32 170.32 15.9 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.693 0.758 . . . . 0.0 112.687 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 0.854 HG12 ' H ' ' A' ' 65' ' ' TYR . 43.8 mt -149.54 165.94 3.36 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.48 -1.236 . . . . 0.0 110.341 179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.059 HG11 ' HB ' ' B' ' 38' ' ' ILE . 2.4 p -161.06 116.02 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-O 120.787 0.327 . . . . 0.0 111.13 -179.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.725 ' CA ' ' HA ' ' A' ' 62' ' ' PHE . . . -136.38 -113.04 1.22 Allowed Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.733 -0.746 . . . . 0.0 112.234 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.814 ' CZ ' ' HB3' ' A' ' 61' ' ' ASN . 0.0 OUTLIER 174.59 -4.6 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 120.579 0.228 . . . . 0.0 111.59 -179.594 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.583 ' O ' ' HG2' ' A' ' 35' ' ' GLU . 0.1 OUTLIER -170.86 34.61 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.571 -0.286 . . . . 0.0 111.434 -179.663 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.624 ' CD1' ' N ' ' B' ' 63' ' ' GLY . 9.5 p90 -99.84 -169.61 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.853 0.359 . . . . 0.0 111.092 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.673 ' HA3' ' N ' ' A' ' 36' ' ' LYS . . . -147.5 96.69 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 121.0 -0.619 . . . . 0.0 111.742 179.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.995 ' CB ' HD12 ' A' ' 57' ' ' ILE . 8.8 p -81.46 149.15 28.9 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.141 0.496 . . . . 0.0 111.78 -179.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.815 ' CD2' ' HA ' ' A' ' 40' ' ' ALA . 15.9 t80 -152.2 69.07 0.88 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.147 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 1.046 HG13 HD11 ' A' ' 57' ' ' ILE . 10.2 m -114.68 150.25 16.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.322 -179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.892 HG21 ' CG2' ' A' ' 53' ' ' THR . 5.2 t -77.26 119.49 20.99 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.082 179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.557 ' HB3' ' O ' ' B' ' 72' ' ' HIS . 0.0 OUTLIER -83.72 148.05 27.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.71 179.807 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.755 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.2 OUTLIER -130.88 -105.44 0.28 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.163 -179.893 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.613 ' CG2' ' HB2' ' B' ' 87' ' ' LYS . 0.2 OUTLIER -37.54 -101.58 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.479 -179.728 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.62 ' HB3' ' SD ' ' B' ' 13' ' ' MET . 2.9 mmtp -80.81 55.91 2.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.789 -179.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.737 ' O ' ' HB3' ' B' ' 73' ' ' PHE . 9.5 m80 30.99 -89.5 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.894 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.777 ' HB2' ' O ' ' B' ' 85' ' ' LEU . 0.2 OUTLIER 165.18 -179.67 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.519 179.872 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 1.024 HD12 ' HA ' ' B' ' 18' ' ' GLN . 1.1 tt -151.83 115.13 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.928 179.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.639 ' HE2' ' HG ' ' B' ' 64' ' ' SER . 0.9 OUTLIER -111.39 92.76 4.16 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.812 179.972 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.98 ' HB3' HG13 ' B' ' 8' ' ' ILE . 1.2 p90 -111.04 168.85 9.18 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.348 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.647 ' HA ' ' HA ' ' B' ' 82' ' ' ALA . 49.1 t80 -130.64 112.98 13.63 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.618 179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 1.051 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 0.6 OUTLIER -69.16 170.36 10.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.924 -179.83 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.493 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.75 -48.74 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 121.092 -0.575 . . . . 0.0 112.781 -179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.514 ' HA ' ' OH ' ' B' ' 77' ' ' TYR . 0.7 OUTLIER -145.95 37.57 1.06 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.862 0.363 . . . . 0.0 110.987 179.814 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.679 HG12 ' N ' ' B' ' 82' ' ' ALA . 69.5 t -154.68 169.08 0.85 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.01 179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.969 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.6 157.74 40.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.664 179.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.969 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -145.07 117.12 2.21 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 120.979 0.419 . . . . 0.0 111.548 -179.702 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 0.9 HD22 ' HB3' ' B' ' 64' ' ' SER . 0.1 OUTLIER -106.74 92.29 4.04 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.8 -0.636 . . . . 0.0 110.177 179.477 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 1.019 HD11 HG21 ' B' ' 42' ' ' ILE . 0.2 OUTLIER -96.3 143.74 27.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.529 -179.405 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.763 ' CE1' HG21 ' B' ' 66' ' ' VAL . 2.4 p90 179.17 136.97 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.729 179.424 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.776 ' HD2' ' CE2' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -103.74 162.88 12.72 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.647 179.506 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.822 ' HB2' ' NE2' ' B' ' 55' ' ' HIS . 0.4 OUTLIER -119.52 21.02 12.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.193 0.52 . . . . 0.0 110.797 179.954 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.009 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.495 -179.954 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.578 ' O ' ' HB2' ' A' ' 2' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.332 0 CA-C-O 120.847 0.356 . . . . 0.0 111.25 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.578 ' HB2' ' O ' ' A' ' 1' ' ' MET . 42.3 t 170.24 -12.6 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.783 179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.742 ' OD1' HG21 ' A' ' 26' ' ' THR . 9.4 t70 -131.82 -81.57 0.51 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.891 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.516 ' HB2' ' H ' ' A' ' 5' ' ' LYS . 0.1 OUTLIER 70.68 -101.11 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.054 179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.516 ' H ' ' HB2' ' A' ' 4' ' ' ARG . 0.2 OUTLIER 61.31 30.03 18.9 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.645 -179.865 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 1.089 ' HA ' ' HA ' ' A' ' 78' ' ' LEU . . . -125.11 -165.48 1.41 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.398 -179.885 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.574 ' N ' ' O ' ' A' ' 77' ' ' TYR . 79.4 t -155.21 73.63 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.619 -0.718 . . . . 0.0 110.467 179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ILE . . . . . 0.947 HG13 ' HB3' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -41.52 158.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.191 0.52 . . . . 0.0 110.77 -179.515 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.761 ' HG2' ' C ' ' A' ' 8' ' ' ILE . 6.9 mmtt -156.87 -11.91 0.09 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.496 -0.775 . . . . 0.0 110.1 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASN . . . . . 0.501 ' O ' ' N ' ' A' ' 75' ' ' TYR . 0.1 OUTLIER -169.39 87.35 0.16 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.502 -179.817 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.949 ' HB1' ' NE2' ' A' ' 18' ' ' GLN . . . -123.61 95.77 4.71 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.836 -179.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.781 ' HB2' ' HD2' ' A' ' 73' ' ' PHE . 8.4 m-20 -84.78 36.49 0.61 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.275 179.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.859 ' SD ' ' HA ' ' A' ' 72' ' ' HIS . 14.2 ttp -125.19 164.41 20.33 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.051 -179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.613 ' H ' ' HG3' ' A' ' 13' ' ' MET . 52.8 p -55.81 123.89 15.72 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.782 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.859 ' HA ' ' HG3' ' A' ' 18' ' ' GLN . 8.8 mt-10 -29.35 -68.96 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.351 -179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -44.38 -41.83 6.43 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.121 -179.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . 0.802 ' HB3' ' SD ' ' A' ' 13' ' ' MET . 0.0 OUTLIER -65.69 -31.02 71.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.143 -179.823 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.949 ' NE2' ' HB1' ' A' ' 11' ' ' ALA . 0.0 OUTLIER -71.74 -34.54 69.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.023 -179.801 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.553 ' O ' ' HG3' ' A' ' 23' ' ' GLU . 0.0 OUTLIER -75.27 -40.45 58.79 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.198 0.523 . . . . 0.0 110.043 179.603 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.37 -26.27 62.72 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.825 179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.843 ' HA ' ' CE1' ' A' ' 46' ' ' PHE . 35.1 t -71.34 -43.74 66.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.197 179.302 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 18' ' ' GLN . 40.5 t -61.01 -46.2 97.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.354 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.643 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 64.9 mt-10 -57.68 -43.11 84.85 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.312 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.564 ' HB2' ' HE1' ' A' ' 46' ' ' PHE . 3.3 m -64.21 -36.62 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.199 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.99 ' HA ' HG12 ' A' ' 42' ' ' ILE . . . -69.83 -33.47 72.34 Favored 'General case' 0 CA--C 1.511 -0.536 0 N-CA-C 108.293 -1.002 . . . . 0.0 108.293 178.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.742 HG21 ' OD1' ' A' ' 3' ' ' ASP . 24.0 m -68.86 -38.09 79.5 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-N 114.154 -1.384 . . . . 0.0 109.675 178.578 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.777 ' O ' ' HD2' ' A' ' 31' ' ' LYS . 21.7 mm100 -60.34 -40.67 91.51 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.587 -0.733 . . . . 0.0 109.98 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.936 ' HB2' ' CD2' ' A' ' 41' ' ' HIS . . . -69.28 -33.58 73.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.919 -0.582 . . . . 0.0 109.743 179.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.862 HD21 HG11 ' A' ' 81' ' ' VAL . 1.2 mt -67.94 -45.93 72.9 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.894 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.91 -26.5 65.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.714 -179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.777 ' HD2' ' O ' ' A' ' 27' ' ' GLN . 5.9 mttp -88.75 -25.72 22.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.844 179.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.522 ' HE1' ' CB ' ' A' ' 41' ' ' HIS . 0.0 OUTLIER -160.07 140.66 11.95 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.584 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.523 ' C ' HD13 ' A' ' 34' ' ' ILE . 1.4 t-20 -103.57 30.15 5.21 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.989 0.423 . . . . 0.0 110.946 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 1.009 ' HB ' ' HB2' ' A' ' 37' ' ' ASP . 3.9 mm -112.5 104.81 17.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.112 179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 1.023 ' HA ' HD12 ' A' ' 38' ' ' ILE . 13.2 mp0 -24.34 -79.97 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.2 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.657 ' N ' ' HA3' ' B' ' 63' ' ' GLY . 0.2 OUTLIER -40.19 -48.07 2.5 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.766 179.737 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 1.009 ' HB2' ' HB ' ' A' ' 34' ' ' ILE . 0.6 OUTLIER -56.8 -54.66 43.81 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.793 179.822 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 1.023 HD12 ' HA ' ' A' ' 35' ' ' GLU . 2.8 mt -50.46 -48.82 25.65 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.933 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.989 ' HB2' HG12 ' A' ' 58' ' ' VAL . . . -55.46 -61.98 1.98 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.846 179.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.822 ' HA ' ' CE2' ' B' ' 65' ' ' TYR . . . -39.81 -59.67 1.13 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.012 0.434 . . . . 0.0 110.437 179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.936 ' CD2' ' HB2' ' A' ' 28' ' ' ALA . 0.1 OUTLIER -49.45 -51.54 34.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.206 179.376 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.99 HG12 ' HA ' ' A' ' 25' ' ' ALA . 8.2 mt -54.04 -65.31 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.745 -0.661 . . . . 0.0 111.225 -179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.74 ' HD2' ' O ' ' A' ' 54' ' ' TRP . 22.6 tttm -46.86 -69.47 0.13 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.066 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 44' ' ' LYS . 15.3 mmtt -33.18 -59.0 0.37 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.969 -179.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.747 ' O ' ' HB2' ' A' ' 49' ' ' LYS . 3.8 tp10 -65.08 -30.67 71.65 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.706 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . 0.843 ' CE1' ' HA ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -79.1 -7.48 58.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.244 -179.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.808 ' O ' ' HD3' ' A' ' 52' ' ' PRO . 7.0 m-20 -101.45 -29.07 12.22 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.158 0.504 . . . . 0.0 110.04 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.577 ' O ' ' HG3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -93.76 -23.38 18.21 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.867 179.805 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.747 ' HB2' ' O ' ' A' ' 45' ' ' GLU . 0.1 OUTLIER -89.48 -17.27 28.99 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.217 -179.676 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.745 ' O ' ' HB3' ' A' ' 51' ' ' ASN . 4.2 m-85 -137.91 -64.54 0.54 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.496 -0.32 . . . . 0.0 111.338 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.745 ' HB3' ' O ' ' A' ' 50' ' ' TYR . 0.1 OUTLIER 157.24 119.05 0.0 OUTLIER Pre-proline 0 N--CA 1.461 0.113 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.552 -179.754 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.808 ' HD3' ' O ' ' A' ' 47' ' ' ASP . 39.5 Cg_endo -66.07 170.47 11.71 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 122.56 2.174 . . . . 0.0 112.465 179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.752 ' O ' ' HB3' ' A' ' 87' ' ' LYS . 0.3 OUTLIER -104.4 132.39 50.7 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 122.834 0.453 . . . . 0.0 110.634 -0.147 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TRP . . . . . 0.773 ' CZ3' ' HB3' ' A' ' 72' ' ' HIS . 42.7 m95 -99.78 92.46 5.33 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.298 -179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.78 ' C ' HG12 ' B' ' 66' ' ' VAL . 2.4 m170 -62.12 88.85 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 1.082 ' HB2' HD12 ' A' ' 85' ' ' LEU . 0.7 OUTLIER -103.66 131.08 51.13 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.916 -0.584 . . . . 0.0 112.306 -178.232 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.977 ' CG1' HD23 ' A' ' 84' ' ' LEU . 19.3 mm -123.7 100.31 7.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.566 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.989 HG12 ' HB2' ' A' ' 39' ' ' ALA . 3.0 p -98.71 118.43 45.26 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.13 -179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.883 ' HA3' ' HB2' ' B' ' 62' ' ' PHE . . . -138.72 -128.66 2.6 Favored Glycine 0 N--CA 1.447 -0.602 0 C-N-CA 120.847 -0.692 . . . . 0.0 111.902 179.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.575 ' HE ' ' HB3' ' B' ' 61' ' ' ASN . 0.0 OUTLIER -165.75 -1.59 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 120.762 0.315 . . . . 0.0 111.051 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.673 HD22 ' HE ' ' B' ' 60' ' ' ARG . 16.8 t30 174.72 35.27 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.924 179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.816 ' HB3' ' HB3' ' B' ' 62' ' ' PHE . 6.7 p90 -87.08 166.56 14.93 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.051 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.877 ' N ' ' HB3' ' B' ' 35' ' ' GLU . . . -116.35 84.32 0.36 Allowed Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.382 -0.687 . . . . 0.0 111.382 179.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.821 ' CB ' HD22 ' A' ' 84' ' ' LEU . 90.0 p -80.84 125.19 29.78 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.105 0.479 . . . . 0.0 111.947 -178.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.81 ' CD2' ' HA ' ' B' ' 40' ' ' ALA . 36.5 t80 -131.42 66.73 1.53 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.708 179.015 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.851 HG12 ' HB3' ' B' ' 55' ' ' HIS . 3.0 m -99.8 172.67 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 115.795 -0.638 . . . . 0.0 111.266 -179.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.808 HG21 HG21 ' B' ' 53' ' ' THR . 15.5 m -111.02 72.98 0.8 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.703 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' HIS . . . . . 0.509 ' NE2' ' OD2' ' A' ' 12' ' ' ASP . 24.1 p-80 -56.44 -164.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.205 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.462 ' N ' ' CD2' ' A' ' 68' ' ' HIS . 11.4 pt-20 168.37 -153.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.667 -179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.487 ' C ' ' HG2' ' A' ' 71' ' ' LYS . 0.0 OUTLIER 51.88 -99.29 0.08 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.006 179.819 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.776 ' O ' ' HA ' ' A' ' 13' ' ' MET . 3.0 pttt 173.67 20.48 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.79 -179.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.859 ' HA ' ' SD ' ' A' ' 13' ' ' MET . 62.7 m-70 -121.78 43.72 2.77 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.757 179.872 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . 0.781 ' HD2' ' HB2' ' A' ' 12' ' ' ASP . 3.7 t80 -116.06 110.7 19.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.499 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.833 HD12 ' CA ' ' A' ' 18' ' ' GLN . 1.3 tt -123.65 127.12 73.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-O 120.875 0.369 . . . . 0.0 111.317 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.501 ' N ' ' O ' ' A' ' 10' ' ' ASN . 58.6 t80 -120.96 110.12 15.9 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.451 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.947 ' HB3' HG13 ' A' ' 8' ' ' ILE . 2.2 p90 -135.68 173.89 11.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.24 -179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.716 ' OH ' ' HA ' ' A' ' 80' ' ' GLN . 28.4 t80 -127.23 113.95 17.0 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.052 179.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.089 ' HA ' ' HA ' ' A' ' 6' ' ' ALA . 0.9 OUTLIER -78.4 -178.3 5.69 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.684 179.834 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . 0.623 ' O ' ' HB2' ' A' ' 80' ' ' GLN . . . -60.42 90.82 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.236 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.074 179.724 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLN . . . . . 0.716 ' HA ' ' OH ' ' A' ' 77' ' ' TYR . 31.6 mt-30 78.19 21.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.865 0.364 . . . . 0.0 110.622 -179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.862 HG11 HD21 ' A' ' 29' ' ' LEU . 90.0 t -151.2 171.54 1.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.881 -179.778 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.782 ' O ' HD13 ' A' ' 83' ' ' ILE . . . -147.95 153.61 39.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.013 -179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.782 HD13 ' O ' ' A' ' 82' ' ' ALA . 0.3 OUTLIER -136.29 127.29 42.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.134 -179.921 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.977 HD23 ' CG1' ' A' ' 57' ' ' ILE . 4.1 tp -111.69 86.6 2.37 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.651 179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 1.082 HD12 ' HB2' ' A' ' 56' ' ' CYS . 0.4 OUTLIER -93.34 125.99 38.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.134 -179.67 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.787 ' CE1' HG21 ' A' ' 66' ' ' VAL . 7.5 p90 -166.72 134.74 2.69 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.032 179.665 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.752 ' HB3' ' O ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -103.99 -162.16 0.88 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.648 179.828 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' SER . . . . . 0.459 ' HA ' ' OE2' ' A' ' 69' ' ' GLU . 0.4 OUTLIER -146.6 18.84 1.32 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.176 0.512 . . . . 0.0 110.981 -179.91 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.028 0 CA-C-O 118.436 -1.202 . . . . 0.0 112.599 179.989 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.444 ' HB3' ' H ' ' B' ' 2' ' ' CYS . 22.7 mmt . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.756 0.313 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' CYS . . . . . 0.444 ' H ' ' HB3' ' B' ' 1' ' ' MET . 69.6 m 39.98 90.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.803 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -50.63 -16.43 0.38 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.85 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' ARG . . . . . 0.443 ' HA ' ' HD3' ' B' ' 4' ' ' ARG . 6.6 mmt85 -55.69 -56.14 23.99 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.717 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' B' ' 6' ' ' ALA . 0.0 OUTLIER 62.07 -174.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.894 179.798 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . 0.997 ' HA ' ' HA ' ' B' ' 78' ' ' LEU . . . 71.77 170.11 0.32 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.447 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' VAL . . . . . 0.661 HG12 ' HE2' ' B' ' 9' ' ' LYS . 89.6 t -134.65 66.96 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.369 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ILE . . . . . 0.767 ' HA ' ' O ' ' B' ' 75' ' ' TYR . 0.8 OUTLIER -28.95 140.7 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.917 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' LYS . . . . . 0.661 ' HE2' HG12 ' B' ' 7' ' ' VAL . 5.7 mmtt -132.13 -0.36 3.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.628 179.858 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' ASN . . . . . 0.499 ' HB2' ' O ' ' B' ' 9' ' ' LYS . 0.1 OUTLIER 171.56 87.04 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.733 -179.914 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.936 ' HB1' HE21 ' B' ' 18' ' ' GLN . . . -119.4 89.86 3.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.57 -179.748 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' ASP . . . . . 0.635 ' HB3' ' CG ' ' B' ' 72' ' ' HIS . 0.5 OUTLIER -91.02 30.05 1.28 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.346 179.459 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.672 ' HG3' ' H ' ' B' ' 14' ' ' SER . 16.2 ttp -117.7 168.42 10.46 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.764 -0.653 . . . . 0.0 110.761 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' SER . . . . . 0.831 ' HB3' ' HG3' ' B' ' 17' ' ' MET . 0.4 OUTLIER -43.02 141.63 1.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.977 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' GLU . . . . . 0.75 ' HA ' ' OE1' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -52.49 -58.28 7.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.674 179.718 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' GLU . . . . . 0.753 ' O ' ' HB2' ' B' ' 20' ' ' ASP . 0.3 OUTLIER -57.79 -26.3 61.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.51 179.624 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' MET . . . . . 0.831 ' HG3' ' HB3' ' B' ' 14' ' ' SER . 0.0 OUTLIER -74.27 -44.3 53.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.547 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' GLN . . . . . 1.034 ' HA ' HD12 ' B' ' 74' ' ' ILE . 0.0 OUTLIER -65.46 -37.29 86.42 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.603 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 73.1 mm-40 -75.32 -41.06 57.72 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.046 -0.524 . . . . 0.0 109.635 179.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' ASP . . . . . 0.753 ' HB2' ' O ' ' B' ' 16' ' ' GLU . 0.4 OUTLIER -69.81 -27.96 65.32 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.736 -0.666 . . . . 0.0 109.482 178.839 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' SER . . . . . 0.786 ' HA ' ' CE1' ' B' ' 46' ' ' PHE . 0.0 OUTLIER -67.37 -47.35 70.65 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.091 179.173 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.904 HG22 ' CD2' ' B' ' 76' ' ' PHE . 73.9 t -58.22 -48.65 84.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.438 179.315 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -56.1 -39.32 71.97 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.404 179.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' CYS . . . . . 0.548 ' SG ' ' HB3' ' B' ' 45' ' ' GLU . 0.1 OUTLIER -65.61 -36.02 82.5 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.985 0.421 . . . . 0.0 110.045 179.319 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.778 ' C ' HD12 ' B' ' 29' ' ' LEU . . . -68.81 -35.68 77.3 Favored 'General case' 0 CA--C 1.51 -0.569 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.585 ' HA ' ' HB2' ' B' ' 29' ' ' LEU . 4.1 m -65.45 -44.25 87.81 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.744 178.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' GLN . . . . . 0.759 ' O ' ' HD2' ' B' ' 31' ' ' LYS . 10.6 mm100 -51.99 -49.32 63.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.728 -0.669 . . . . 0.0 109.686 179.184 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' ALA . . . . . 0.827 ' HB1' ' HA ' ' B' ' 38' ' ' ILE . . . -75.42 -16.13 60.38 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.605 179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.778 HD12 ' C ' ' B' ' 25' ' ' ALA . 5.2 mt -82.12 -33.8 29.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.246 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -85.11 -33.66 22.34 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.386 -179.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . 0.759 ' HD2' ' O ' ' B' ' 27' ' ' GLN . 0.1 OUTLIER -78.68 -29.25 45.47 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.952 0.406 . . . . 0.0 110.548 179.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' TYR . . . . . 0.63 ' CD1' ' N ' ' B' ' 32' ' ' TYR . 0.0 OUTLIER -149.39 151.65 34.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.64 179.789 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' ASN . . . . . 0.612 ' C ' HD13 ' B' ' 34' ' ' ILE . 12.2 m-80 -115.29 30.54 7.29 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.957 179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.953 ' HB ' ' HB2' ' B' ' 37' ' ' ASP . 1.1 mm -109.29 106.83 21.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.084 -179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' GLU . . . . . 0.877 ' HB3' ' N ' ' A' ' 63' ' ' GLY . 15.0 mm-40 -31.6 -70.21 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.9 -179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' LYS . . . . . 0.509 ' N ' ' HA3' ' A' ' 63' ' ' GLY . 5.2 mtmm -45.91 -61.05 1.9 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.873 0.368 . . . . 0.0 110.594 179.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' ASP . . . . . 0.953 ' HB2' ' HB ' ' B' ' 34' ' ' ILE . 4.1 m-20 -44.68 -63.6 0.87 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.765 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.827 ' HA ' ' HB1' ' B' ' 28' ' ' ALA . 4.4 mt -43.63 -57.28 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.141 179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' ALA . . . . . 1.05 ' HB2' HG12 ' B' ' 58' ' ' VAL . . . -49.14 -41.55 36.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.002 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.81 ' HA ' ' CD2' ' A' ' 65' ' ' TYR . . . -59.96 -64.49 0.93 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.059 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.577 ' H ' ' CD2' ' B' ' 41' ' ' HIS . 0.2 OUTLIER -47.34 -39.37 14.77 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.99 -179.983 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' ILE . . . . . 0.716 HG21 HD11 ' B' ' 85' ' ' LEU . 81.9 mt -59.1 -60.98 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.973 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.822 ' HB2' ' SG ' ' B' ' 56' ' ' CYS . 0.1 OUTLIER -46.34 -55.58 7.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.893 179.949 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.595 ' O ' ' HB3' ' B' ' 48' ' ' LYS . 0.1 OUTLIER -53.85 -35.79 61.9 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 -179.893 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . 0.739 ' O ' ' HB2' ' B' ' 49' ' ' LYS . 5.2 mm-40 -74.43 -40.32 62.04 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.368 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' PHE . . . . . 0.786 ' CE1' ' HA ' ' B' ' 21' ' ' SER . 0.8 OUTLIER -70.77 -35.03 72.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.846 0.355 . . . . 0.0 110.715 179.99 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' ASP . . . . . 0.807 ' O ' ' HD3' ' B' ' 52' ' ' PRO . 1.9 m-20 -74.18 -31.47 62.69 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.098 0.475 . . . . 0.0 109.91 179.413 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.595 ' HB3' ' O ' ' B' ' 44' ' ' LYS . 0.0 OUTLIER -90.0 -24.17 21.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.663 179.888 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' LYS . . . . . 0.739 ' HB2' ' O ' ' B' ' 45' ' ' GLU . 0.0 OUTLIER -90.24 -30.41 17.56 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 -179.572 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.668 ' OH ' ' HB3' ' B' ' 20' ' ' ASP . 28.4 m-85 -123.85 -59.55 1.51 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.599 -179.528 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' ASN . . . . . 0.503 ' CB ' ' O ' ' B' ' 50' ' ' TYR . 0.8 OUTLIER 155.32 118.92 0.0 OUTLIER Pre-proline 0 C--O 1.231 0.097 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.093 -179.609 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' PRO . . . . . 0.807 ' HD3' ' O ' ' B' ' 47' ' ' ASP . 18.1 Cg_endo -58.15 167.97 4.07 Favored 'Trans proline' 0 CA--C 1.532 0.387 0 C-N-CA 122.44 2.094 . . . . 0.0 112.502 -179.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' THR . . . . . 0.808 HG21 HG21 ' A' ' 67' ' ' THR . 11.3 t -110.71 120.03 41.06 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 122.749 0.42 . . . . 0.0 110.653 0.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' TRP . . . . . 0.83 ' HA ' ' HB3' ' B' ' 87' ' ' LYS . 27.6 m95 -92.7 117.01 29.54 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.918 -179.359 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' HIS . . . . . 0.851 ' HB3' HG12 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -85.15 91.33 8.1 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.928 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' CYS . . . . . 0.822 ' SG ' ' HB2' ' B' ' 43' ' ' LYS . 5.7 p -101.8 150.5 23.09 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -177.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' ILE . . . . . 1.017 HG13 HD23 ' B' ' 84' ' ' LEU . 13.3 mm -130.56 159.34 42.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.077 -0.965 . . . . 0.0 109.883 178.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' VAL . . . . . 1.05 HG12 ' HB2' ' B' ' 39' ' ' ALA . 2.3 p -162.03 108.46 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-O 120.89 0.376 . . . . 0.0 111.046 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' GLY . . . . . 0.818 ' O ' HG13 ' B' ' 81' ' ' VAL . . . -129.21 -133.93 3.7 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.733 -0.746 . . . . 0.0 111.953 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' ARG . . . . . 0.673 ' HE ' HD22 ' A' ' 61' ' ' ASN . 0.0 OUTLIER -165.83 -9.17 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 120.707 0.289 . . . . 0.0 111.36 -179.768 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' ASN . . . . . 0.575 ' HB3' ' HE ' ' A' ' 60' ' ' ARG . 0.6 OUTLIER -170.54 34.98 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.367 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.883 ' HB2' ' HA3' ' A' ' 59' ' ' GLY . 17.5 p90 -103.05 -168.61 1.54 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.852 0.358 . . . . 0.0 110.682 179.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' GLY . . . . . 0.853 ' N ' ' HB3' ' A' ' 35' ' ' GLU . . . -143.33 106.12 0.41 Allowed Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.041 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.951 ' HB2' HD22 ' B' ' 84' ' ' LEU . 63.1 p -89.81 134.93 33.92 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.082 0.467 . . . . 0.0 111.47 -179.461 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' TYR . . . . . 0.822 ' CE2' ' HA ' ' A' ' 40' ' ' ALA . 56.3 t80 -144.96 79.34 1.59 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.997 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.842 HG13 HD11 ' A' ' 57' ' ' ILE . 4.9 m -131.51 166.75 27.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.939 -0.573 . . . . 0.0 111.565 -179.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' THR . . . . . 0.614 HG22 ' NE2' ' A' ' 55' ' ' HIS . 1.6 t -79.32 170.11 17.09 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.584 179.662 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' HIS . . . . . 0.818 ' HB3' ' CD2' ' B' ' 73' ' ' PHE . 2.4 p-80 -129.85 154.9 46.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.17 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.711 ' HG3' ' HA ' ' B' ' 88' ' ' SER . 0.0 OUTLIER -143.32 170.41 15.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.815 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' THR . . . . . 0.434 ' HB ' ' H ' ' B' ' 71' ' ' LYS . 0.2 OUTLIER 44.49 -95.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.122 -179.985 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' LYS . . . . . 0.623 ' O ' ' HB2' ' B' ' 13' ' ' MET . 7.1 mmtt -92.17 35.05 1.0 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.098 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' HIS . . . . . 0.751 ' HA ' ' HB2' ' B' ' 68' ' ' HIS . 13.5 m-70 51.08 -85.19 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.084 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . 0.818 ' CD2' ' HB3' ' B' ' 68' ' ' HIS . 0.3 OUTLIER 165.52 -166.64 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.706 -179.951 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 1.034 HD12 ' HA ' ' B' ' 18' ' ' GLN . 0.1 OUTLIER -162.22 124.38 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.99 0.424 . . . . 0.0 111.666 179.529 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' TYR . . . . . 0.97 ' CZ ' HD13 ' B' ' 84' ' ' LEU . 0.5 OUTLIER -113.82 146.38 40.04 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.92 178.87 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . 0.909 ' HE1' HG23 ' B' ' 74' ' ' ILE . 1.4 p90 -170.33 149.15 3.34 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.849 0.357 . . . . 0.0 111.184 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' TYR . . . . . 0.603 ' O ' ' N ' ' B' ' 7' ' ' VAL . 1.3 t80 -113.99 112.03 22.62 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.83 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' LEU . . . . . 0.997 ' HA ' ' HA ' ' B' ' 6' ' ' ALA . 2.6 mm? -69.18 169.67 11.59 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.555 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.49 ' C ' ' O ' ' B' ' 78' ' ' LEU . . . -26.53 -42.64 0.02 OUTLIER Glycine 0 CA--C 1.518 0.232 0 C-N-CA 121.088 -0.577 . . . . 0.0 112.89 -179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.74 HE21 ' HA ' ' B' ' 80' ' ' GLN . 0.0 OUTLIER -153.55 40.1 0.51 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.971 0.415 . . . . 0.0 110.618 179.905 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' VAL . . . . . 0.818 HG13 ' O ' ' B' ' 59' ' ' GLY . 77.9 t -156.4 168.46 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.055 -179.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' ALA . . . . . 0.999 ' O ' HD13 ' B' ' 83' ' ' ILE . . . -128.58 157.48 41.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.578 179.766 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . 0.999 HD13 ' O ' ' B' ' 82' ' ' ALA . 0.1 OUTLIER -148.57 132.02 8.0 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-O 120.996 0.427 . . . . 0.0 111.831 -179.596 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' LEU . . . . . 1.017 HD23 HG13 ' B' ' 57' ' ' ILE . 0.1 OUTLIER -125.19 101.32 6.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.257 179.332 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' LEU . . . . . 0.796 ' O ' ' HB2' ' B' ' 73' ' ' PHE . 3.6 mp -101.1 133.73 45.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.12 -179.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' PHE . . . . . 0.704 ' CE1' ' HB2' ' B' ' 55' ' ' HIS . 3.2 p90 -172.68 122.31 0.42 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.421 179.624 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' LYS . . . . . 0.83 ' HB3' ' HA ' ' B' ' 54' ' ' TRP . 0.1 OUTLIER -104.75 168.34 9.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.658 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' SER . . . . . 0.711 ' HA ' ' HG3' ' B' ' 69' ' ' GLU . 4.3 m -122.15 19.45 10.72 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.319 0.58 . . . . 0.0 110.815 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.437 -1.202 . . . . 0.0 112.546 -179.968 . . . . . . . . 0 0 . 1 stop_ save_